1-[2-(2-ethylpiperidin-1-yl)-2-oxidanylidene-ethyl]-3-methyl-5-phenyl-3H-1,4-benzodiazepin-2-one

Systemtic Name: 1-[2-(2-ethylpiperidin-1-yl)-2-oxidanylidene-ethyl]-3-methyl-5-phenyl-3H-1,4-benzodiazepin-2-one Openeye Name: 1-[2-(2-ethyl-1-piperidyl)-2-oxo-ethyl]-3-methyl-5-phenyl-3H-1,4-benzodiazepin-2-one CAS Name: 1-[2-(2-ethyl-1-piperidinyl)-2-oxoethyl]-3-methyl-5-phenyl-3H-1,4-benzodiazepin-2-one IUPAC Name: 1-[2-(2-ethylpiperidin-1-yl)-2-oxoethyl]-3-methyl-5-phenyl-3H-1,4-benzodiazepin-2-one Traditional Name: 1-[2-(2-ethylpiperidino)-2-keto-ethyl]-3-methyl-5-phenyl-3H-1,4-benzodiazepin-2-one Formula: C25H29N3O2 MolecularWeight: 403.51666

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCCN1C(=O)CN2C3=CC=CC=C3C(=NC(C2=O)C)C4=CC=CC=C4

Isomeric SMILES

CCC1CCCCN1C(=O)CN2C3=CC=CC=C3C(=NC(C2=O)C)C4=CC=CC=C4

InChI

InChI=1S/C25H29N3O2/c1-3-20-13-9-10-16-27(20)23(29)17-28-22-15-8-7-14-21(22)24(26-18(2)25(28)30)19-11-5-4-6-12-19/h4-8,11-12,14-15,18,20H,3,9-10,13,16-17H2,1-2H3