N-(2-azanylethyl)-2-cyclohexyl-1-cyclopropylcarbonyl-4-oxidanylidene-3,5-dihydro-2H-1,5-benzodiazepine-7-carboxamide

Systemtic Name: N-(2-azanylethyl)-2-cyclohexyl-1-cyclopropylcarbonyl-4-oxidanylidene-3,5-dihydro-2H-1,5-benzodiazepine-7-carboxamide Openeye Name: N-(2-aminoethyl)-2-cyclohexyl-1-(cyclopropanecarbonyl)-4-oxo-3,5-dihydro-2H-1,5-benzodiazepine-7-carboxamide CAS Name: N-(2-aminoethyl)-2-cyclohexyl-1-[cyclopropyl(oxo)methyl]-4-oxo-3,5-dihydro-2H-1,5-benzodiazepine-7-carboxamide IUPAC Name: N-(2-aminoethyl)-2-cyclohexyl-1-(cyclopropanecarbonyl)-4-oxo-3,5-dihydro-2H-1,5-benzodiazepine-7-carboxamide Traditional Name: N-(2-aminoethyl)-2-cyclohexyl-1-(cyclopropanecarbonyl)-4-keto-3,5-dihydro-2H-1,5-benzodiazepine-7-carboxamide Formula: C22H30N4O3 MolecularWeight: 398.4986

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2CC(=O)NC3=C(N2C(=O)C4CC4)C=CC(=C3)C(=O)NCCN

Isomeric SMILES

C1CCC(CC1)C2CC(=O)NC3=C(N2C(=O)C4CC4)C=CC(=C3)C(=O)NCCN

InChI

InChI=1S/C22H30N4O3/c23-10-11-24-21(28)16-8-9-18-17(12-16)25-20(27)13-19(14-4-2-1-3-5-14)26(18)22(29)15-6-7-15/h8-9,12,14-15,19H,1-7,10-11,13,23H2,(H,24,28)(H,25,27)