2-cyclohexyl-N-[5-[cyclohexyl(methyl)amino]-2-oxidanylidene-1-propyl-3H-1,4-benzodiazepin-3-yl]ethanamide

Systemtic Name: 2-cyclohexyl-N-[5-[cyclohexyl(methyl)amino]-2-oxidanylidene-1-propyl-3H-1,4-benzodiazepin-3-yl]ethanamide Openeye Name: 2-cyclohexyl-N-[5-[cyclohexyl(methyl)amino]-2-oxo-1-propyl-3H-1,4-benzodiazepin-3-yl]acetamide CAS Name: 2-cyclohexyl-N-[5-[cyclohexyl(methyl)amino]-2-oxo-1-propyl-3H-1,4-benzodiazepin-3-yl]acetamide IUPAC Name: 2-cyclohexyl-N-[5-[cyclohexyl(methyl)amino]-2-oxo-1-propyl-3H-1,4-benzodiazepin-3-yl]acetamide Traditional Name: 2-cyclohexyl-N-[5-[cyclohexyl(methyl)amino]-2-keto-1-propyl-3H-1,4-benzodiazepin-3-yl]acetamide Formula: C27H40N4O2 MolecularWeight: 452.6321

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=CC=CC=C2C(=NC(C1=O)NC(=O)CC3CCCCC3)N(C)C4CCCCC4

Isomeric SMILES

CCCN1C2=CC=CC=C2C(=NC(C1=O)NC(=O)CC3CCCCC3)N(C)C4CCCCC4

InChI

InChI=1S/C27H40N4O2/c1-3-18-31-23-17-11-10-16-22(23)26(30(2)21-14-8-5-9-15-21)29-25(27(31)33)28-24(32)19-20-12-6-4-7-13-20/h10-11,16-17,20-21,25H,3-9,12-15,18-19H2,1-2H3,(H,28,32)