6,7-dimethyl-1-phenacyl-5-thiophen-2-yl-3H-thieno[2,3-e][1,4]diazepin-2-one

Systemtic Name: 6,7-dimethyl-1-phenacyl-5-thiophen-2-yl-3H-thieno[2,3-e][1,4]diazepin-2-one Openeye Name: 6,7-dimethyl-1-phenacyl-5-(2-thienyl)-3H-thieno[2,3-e][1,4]diazepin-2-one CAS Name: 6,7-dimethyl-1-phenacyl-5-thiophen-2-yl-3H-thieno[2,3-e][1,4]diazepin-2-one IUPAC Name: 6,7-dimethyl-1-phenacyl-5-thiophen-2-yl-3H-thieno[2,3-e][1,4]diazepin-2-one Traditional Name: 6,7-dimethyl-1-phenacyl-5-(2-thienyl)-3H-thieno[2,3-e][1,4]diazepin-2-one Formula: C21H18N2O2S2 MolecularWeight: 394.50982

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=NCC(=O)N2CC(=O)C3=CC=CC=C3)C4=CC=CS4)C

Isomeric SMILES

CC1=C(SC2=C1C(=NCC(=O)N2CC(=O)C3=CC=CC=C3)C4=CC=CS4)C

InChI

InChI=1S/C21H18N2O2S2/c1-13-14(2)27-21-19(13)20(17-9-6-10-26-17)22-11-18(25)23(21)12-16(24)15-7-4-3-5-8-15/h3-10H,11-12H2,1-2H3