7-bromanyl-5-thiophen-2-yl-4-(3,4,5-trimethoxyphenyl)carbonyl-3,5-dihydro-1H-1,4-benzodiazepin-2-one

Systemtic Name: 7-bromanyl-5-thiophen-2-yl-4-(3,4,5-trimethoxyphenyl)carbonyl-3,5-dihydro-1H-1,4-benzodiazepin-2-one Openeye Name: 7-bromo-5-(2-thienyl)-4-(3,4,5-trimethoxybenzoyl)-3,5-dihydro-1H-1,4-benzodiazepin-2-one CAS Name: 7-bromo-4-[oxo-(3,4,5-trimethoxyphenyl)methyl]-5-thiophen-2-yl-3,5-dihydro-1H-1,4-benzodiazepin-2-one IUPAC Name: 7-bromo-5-thiophen-2-yl-4-(3,4,5-trimethoxybenzoyl)-3,5-dihydro-1H-1,4-benzodiazepin-2-one Traditional Name: 7-bromo-5-(2-thienyl)-4-(3,4,5-trimethoxybenzoyl)-3,5-dihydro-1H-1,4-benzodiazepin-2-one Formula: C23H21BrN2O5S MolecularWeight: 517.39224

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=O)N2CC(=O)NC3=C(C2C4=CC=CS4)C=C(C=C3)Br

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)N2CC(=O)NC3=C(C2C4=CC=CS4)C=C(C=C3)Br

InChI

InChI=1S/C23H21BrN2O5S/c1-29-17-9-13(10-18(30-2)22(17)31-3)23(28)26-12-20(27)25-16-7-6-14(24)11-15(16)21(26)19-5-4-8-32-19/h4-11,21H,12H2,1-3H3,(H,25,27)