4-[4-[1-(1,3-benzothiazol-2-yl)ethyl]piperazin-1-yl]carbonyl-5-methyl-2-pyrrol-1-yl-furan-3-carbonitrile

Systemtic Name: 4-[4-[1-(1,3-benzothiazol-2-yl)ethyl]piperazin-1-yl]carbonyl-5-methyl-2-pyrrol-1-yl-furan-3-carbonitrile Openeye Name: 4-[4-[1-(1,3-benzothiazol-2-yl)ethyl]piperazine-1-carbonyl]-5-methyl-2-pyrrol-1-yl-furan-3-carbonitrile CAS Name: 4-[[4-[1-(1,3-benzothiazol-2-yl)ethyl]-1-piperazinyl]-oxomethyl]-5-methyl-2-(1-pyrrolyl)-3-furancarbonitrile IUPAC Name: 4-[4-[1-(1,3-benzothiazol-2-yl)ethyl]piperazine-1-carbonyl]-5-methyl-2-pyrrol-1-ylfuran-3-carbonitrile Traditional Name: 4-[4-[1-(1,3-benzothiazol-2-yl)ethyl]piperazine-1-carbonyl]-5-methyl-2-pyrrol-1-yl-3-furonitrile Formula: C24H23N5O2S MolecularWeight: 445.53672

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(O1)N2C=CC=C2)C#N)C(=O)N3CCN(CC3)C(C)C4=NC5=CC=CC=C5S4

Isomeric SMILES

CC1=C(C(=C(O1)N2C=CC=C2)C#N)C(=O)N3CCN(CC3)C(C)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C24H23N5O2S/c1-16(22-26-19-7-3-4-8-20(19)32-22)27-11-13-28(14-12-27)23(30)21-17(2)31-24(18(21)15-25)29-9-5-6-10-29/h3-10,16H,11-14H2,1-2H3