5-(3-methylphenyl)-1-prop-2-enyl-3H-thieno[2,3-e][1,4]diazepin-2-one

Systemtic Name: 5-(3-methylphenyl)-1-prop-2-enyl-3H-thieno[2,3-e][1,4]diazepin-2-one Openeye Name: 1-allyl-5-(m-tolyl)-3H-thieno[2,3-e][1,4]diazepin-2-one CAS Name: 5-(3-methylphenyl)-1-prop-2-enyl-3H-thieno[2,3-e][1,4]diazepin-2-one IUPAC Name: 5-(3-methylphenyl)-1-prop-2-enyl-3H-thieno[2,3-e][1,4]diazepin-2-one Traditional Name: 1-allyl-5-(m-tolyl)-3H-thieno[2,3-e][1,4]diazepin-2-one Formula: C17H16N2OS MolecularWeight: 296.38674

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H16N2OS/c1-3-8-19-15(20)11-18-16(14-7-9-21-17(14)19)13-6-4-5-12(2)10-13/h3-7,9-10H,1,8,11H2,2H3