N-[4-methyl-5-(1-methylimidazol-2-yl)-1,3-thiazol-2-yl]-4-oxidanylidene-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide

Systemtic Name: N-[4-methyl-5-(1-methylimidazol-2-yl)-1,3-thiazol-2-yl]-4-oxidanylidene-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide Openeye Name: N-[4-methyl-5-(1-methylimidazol-2-yl)thiazol-2-yl]-4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide CAS Name: N-[4-methyl-5-(1-methyl-2-imidazolyl)-2-thiazolyl]-4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide IUPAC Name: N-[4-methyl-5-(1-methylimidazol-2-yl)-1,3-thiazol-2-yl]-4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide Traditional Name: 4-keto-N-[4-methyl-5-(1-methylimidazol-2-yl)thiazol-2-yl]-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide Formula: C18H17N5O2S2 MolecularWeight: 399.48988

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NC(=O)C2=CC3=C(C=C2)SCCC(=O)N3)C4=NC=CN4C

Isomeric SMILES

CC1=C(SC(=N1)NC(=O)C2=CC3=C(C=C2)SCCC(=O)N3)C4=NC=CN4C

InChI

InChI=1S/C18H17N5O2S2/c1-10-15(16-19-6-7-23(16)2)27-18(20-10)22-17(25)11-3-4-13-12(9-11)21-14(24)5-8-26-13/h3-4,6-7,9H,5,8H2,1-2H3,(H,21,24)(H,20,22,25)