2-[3-[(Z)-[(5S)-6-ethanoyl-5-(2-methoxynaphthalen-1-yl)-7-methyl-3-oxidanylidene-5H-[1,3]thiazolo[3,2-a]pyrimidin-2-ylidene]methyl]-2,5-dimethyl-pyrrol-1-yl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile

Systemtic Name: 2-[3-[(Z)-[(5S)-6-ethanoyl-5-(2-methoxynaphthalen-1-yl)-7-methyl-3-oxidanylidene-5H-[1,3]thiazolo[3,2-a]pyrimidin-2-ylidene]methyl]-2,5-dimethyl-pyrrol-1-yl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile Openeye Name: 2-[3-[(Z)-[(5S)-6-acetyl-5-(2-methoxy-1-naphthyl)-7-methyl-3-oxo-5H-thiazolo[3,2-a]pyrimidin-2-ylidene]methyl]-2,5-dimethyl-pyrrol-1-yl]-4,5,6,7-tetrahydrobenzothiophene-3-carbonitrile CAS Name: 2-[3-[(Z)-[(5S)-6-acetyl-5-(2-methoxy-1-naphthalenyl)-7-methyl-3-oxo-5H-thiazolo[3,2-a]pyrimidin-2-ylidene]methyl]-2,5-dimethyl-1-pyrrolyl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile IUPAC Name: 2-[3-[(Z)-[(5S)-6-acetyl-5-(2-methoxynaphthalen-1-yl)-7-methyl-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidin-2-ylidene]methyl]-2,5-dimethylpyrrol-1-yl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile Traditional Name: 2-[3-[(Z)-[(5S)-6-acetyl-3-keto-5-(2-methoxy-1-naphthyl)-7-methyl-5H-thiazolo[3,2-a]pyrimidin-2-ylidene]methyl]-2,5-dimethyl-pyrrol-1-yl]-4,5,6,7-tetrahydrobenzothiophene-3-carbonitrile Formula: C36H32N4O3S2 MolecularWeight: 632.79428

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=C(C3=C(S2)CCCC3)C#N)C)C=C4C(=O)N5C(C(=C(N=C5S4)C)C(=O)C)C6=C(C=CC7=CC=CC=C76)OC

Isomeric SMILES

CC1=CC(=C(N1C2=C(C3=C(S2)CCCC3)C#N)C)/C=C\4/C(=O)N5[C@H](C(=C(N=C5S4)C)C(=O)C)C6=C(C=CC7=CC=CC=C76)OC

InChI

InChI=1S/C36H32N4O3S2/c1-19-16-24(21(3)39(19)35-27(18-37)26-12-8-9-13-29(26)44-35)17-30-34(42)40-33(31(22(4)41)20(2)38-36(40)45-30)32-25-11-7-6-10-23(25)14-15-28(32)43-5/h6-7,10-11,14-17,33H,8-9,12-13H2,1-5H3/b30-17-/t33-/m1/s1