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

Systemtic Name: 4-(3-cyclohexylpropanoyl)-7-methyl-5-thiophen-2-yl-3,5-dihydro-1H-1,4-benzodiazepin-2-one Openeye Name: 4-(3-cyclohexylpropanoyl)-7-methyl-5-(2-thienyl)-3,5-dihydro-1H-1,4-benzodiazepin-2-one CAS Name: 4-(3-cyclohexyl-1-oxopropyl)-7-methyl-5-thiophen-2-yl-3,5-dihydro-1H-1,4-benzodiazepin-2-one IUPAC Name: 4-(3-cyclohexylpropanoyl)-7-methyl-5-thiophen-2-yl-3,5-dihydro-1H-1,4-benzodiazepin-2-one Traditional Name: 4-(3-cyclohexylpropanoyl)-7-methyl-5-(2-thienyl)-3,5-dihydro-1H-1,4-benzodiazepin-2-one Formula: C23H28N2O2S MolecularWeight: 396.54562

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)NC(=O)CN(C2C3=CC=CS3)C(=O)CCC4CCCCC4

Isomeric SMILES

CC1=CC2=C(C=C1)NC(=O)CN(C2C3=CC=CS3)C(=O)CCC4CCCCC4

InChI

InChI=1S/C23H28N2O2S/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/h5,8-9,11,13-14,17,23H,2-4,6-7,10,12,15H2,1H3,(H,24,26)