propyl 4-[[3-[(4-butylphenyl)carbamoyl]-7-methyl-5-oxidanylidene-[1,3]thiazolo[3,2-a]pyrimidin-2-yl]carbonylamino]benzoate

Systemtic Name: propyl 4-[[3-[(4-butylphenyl)carbamoyl]-7-methyl-5-oxidanylidene-[1,3]thiazolo[3,2-a]pyrimidin-2-yl]carbonylamino]benzoate Openeye Name: propyl 4-[[3-[(4-butylphenyl)carbamoyl]-7-methyl-5-oxo-thiazolo[3,2-a]pyrimidine-2-carbonyl]amino]benzoate CAS Name: 4-[[[3-[(4-butylanilino)-oxomethyl]-7-methyl-5-oxo-2-thiazolo[3,2-a]pyrimidinyl]-oxomethyl]amino]benzoic acid propyl ester IUPAC Name: propyl 4-[[3-[(4-butylphenyl)carbamoyl]-7-methyl-5-oxo-[1,3]thiazolo[3,2-a]pyrimidine-2-carbonyl]amino]benzoate Traditional Name: 4-[[3-[(4-butylphenyl)carbamoyl]-5-keto-7-methyl-thiazolo[3,2-a]pyrimidine-2-carbonyl]amino]benzoic acid propyl ester Formula: C29H30N4O5S MolecularWeight: 546.6373

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=O)C2=C(SC3=NC(=CC(=O)N23)C)C(=O)NC4=CC=C(C=C4)C(=O)OCCC

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=O)C2=C(SC3=NC(=CC(=O)N23)C)C(=O)NC4=CC=C(C=C4)C(=O)OCCC

InChI

InChI=1S/C29H30N4O5S/c1-4-6-7-19-8-12-21(13-9-19)31-26(35)24-25(39-29-30-18(3)17-23(34)33(24)29)27(36)32-22-14-10-20(11-15-22)28(37)38-16-5-2/h8-15,17H,4-7,16H2,1-3H3,(H,31,35)(H,32,36)