7-methyl-4-(3-phenylpropanoyl)-5-thiophen-2-yl-3,5-dihydro-1H-1,4-benzodiazepin-2-one

Systemtic Name: 7-methyl-4-(3-phenylpropanoyl)-5-thiophen-2-yl-3,5-dihydro-1H-1,4-benzodiazepin-2-one Openeye Name: 7-methyl-4-(3-phenylpropanoyl)-5-(2-thienyl)-3,5-dihydro-1H-1,4-benzodiazepin-2-one CAS Name: 7-methyl-4-(1-oxo-3-phenylpropyl)-5-thiophen-2-yl-3,5-dihydro-1H-1,4-benzodiazepin-2-one IUPAC Name: 7-methyl-4-(3-phenylpropanoyl)-5-thiophen-2-yl-3,5-dihydro-1H-1,4-benzodiazepin-2-one Traditional Name: 4-hydrocinnamoyl-7-methyl-5-(2-thienyl)-3,5-dihydro-1H-1,4-benzodiazepin-2-one Formula: C23H22N2O2S MolecularWeight: 390.49798

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)NC(=O)CN(C2C3=CC=CS3)C(=O)CCC4=CC=CC=C4

Isomeric SMILES

CC1=CC2=C(C=C1)NC(=O)CN(C2C3=CC=CS3)C(=O)CCC4=CC=CC=C4

InChI

InChI=1S/C23H22N2O2S/c1-16-9-11-19-18(14-16)23(20-8-5-13-28-20)25(15-21(26)24-19)22(27)12-10-17-6-3-2-4-7-17/h2-9,11,13-14,23H,10,12,15H2,1H3,(H,24,26)