3-cyclohexyl-N-[5-(dimethylamino)-1-methyl-2-oxidanylidene-3H-1,4-benzodiazepin-3-yl]propanamide

Systemtic Name: 3-cyclohexyl-N-[5-(dimethylamino)-1-methyl-2-oxidanylidene-3H-1,4-benzodiazepin-3-yl]propanamide Openeye Name: 3-cyclohexyl-N-[5-(dimethylamino)-1-methyl-2-oxo-3H-1,4-benzodiazepin-3-yl]propanamide CAS Name: 3-cyclohexyl-N-[5-(dimethylamino)-1-methyl-2-oxo-3H-1,4-benzodiazepin-3-yl]propanamide IUPAC Name: 3-cyclohexyl-N-[5-(dimethylamino)-1-methyl-2-oxo-3H-1,4-benzodiazepin-3-yl]propanamide Traditional Name: 3-cyclohexyl-N-[5-(dimethylamino)-2-keto-1-methyl-3H-1,4-benzodiazepin-3-yl]propionamide Formula: C21H30N4O2 MolecularWeight: 370.4885

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C(=NC(C1=O)NC(=O)CCC3CCCCC3)N(C)C

Isomeric SMILES

CN1C2=CC=CC=C2C(=NC(C1=O)NC(=O)CCC3CCCCC3)N(C)C

InChI

InChI=1S/C21H30N4O2/c1-24(2)20-16-11-7-8-12-17(16)25(3)21(27)19(23-20)22-18(26)14-13-15-9-5-4-6-10-15/h7-8,11-12,15,19H,4-6,9-10,13-14H2,1-3H3,(H,22,26)