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

Systemtic Name: 5-(3-methylphenyl)-1-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)-3H-thieno[2,3-e][1,4]diazepin-2-one Openeye Name: 5-(m-tolyl)-1-(2-oxo-2-pyrrolidin-1-yl-ethyl)-3H-thieno[2,3-e][1,4]diazepin-2-one CAS Name: 5-(3-methylphenyl)-1-[2-oxo-2-(1-pyrrolidinyl)ethyl]-3H-thieno[2,3-e][1,4]diazepin-2-one IUPAC Name: 5-(3-methylphenyl)-1-(2-oxo-2-pyrrolidin-1-ylethyl)-3H-thieno[2,3-e][1,4]diazepin-2-one Traditional Name: 1-(2-keto-2-pyrrolidino-ethyl)-5-(m-tolyl)-3H-thieno[2,3-e][1,4]diazepin-2-one Formula: C20H21N3O2S MolecularWeight: 367.46464

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=NCC(=O)N(C3=C2C=CS3)CC(=O)N4CCCC4

Isomeric SMILES

CC1=CC=CC(=C1)C2=NCC(=O)N(C3=C2C=CS3)CC(=O)N4CCCC4

InChI

InChI=1S/C20H21N3O2S/c1-14-5-4-6-15(11-14)19-16-7-10-26-20(16)23(17(24)12-21-19)13-18(25)22-8-2-3-9-22/h4-7,10-11H,2-3,8-9,12-13H2,1H3