7-methyl-5-(2-methylphenyl)-1-(2-oxidanylidene-2-piperidin-1-yl-ethyl)-3H-thieno[2,3-e][1,4]diazepin-2-one

Systemtic Name: 7-methyl-5-(2-methylphenyl)-1-(2-oxidanylidene-2-piperidin-1-yl-ethyl)-3H-thieno[2,3-e][1,4]diazepin-2-one Openeye Name: 7-methyl-5-(o-tolyl)-1-[2-oxo-2-(1-piperidyl)ethyl]-3H-thieno[2,3-e][1,4]diazepin-2-one CAS Name: 7-methyl-5-(2-methylphenyl)-1-[2-oxo-2-(1-piperidinyl)ethyl]-3H-thieno[2,3-e][1,4]diazepin-2-one IUPAC Name: 7-methyl-5-(2-methylphenyl)-1-(2-oxo-2-piperidin-1-ylethyl)-3H-thieno[2,3-e][1,4]diazepin-2-one Traditional Name: 1-(2-keto-2-piperidino-ethyl)-7-methyl-5-(o-tolyl)-3H-thieno[2,3-e][1,4]diazepin-2-one Formula: C22H25N3O2S MolecularWeight: 395.5178

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=NCC(=O)N(C3=C2C=C(S3)C)CC(=O)N4CCCCC4

Isomeric SMILES

CC1=CC=CC=C1C2=NCC(=O)N(C3=C2C=C(S3)C)CC(=O)N4CCCCC4

InChI

InChI=1S/C22H25N3O2S/c1-15-8-4-5-9-17(15)21-18-12-16(2)28-22(18)25(19(26)13-23-21)14-20(27)24-10-6-3-7-11-24/h4-5,8-9,12H,3,6-7,10-11,13-14H2,1-2H3