6,7-dimethyl-5-phenyl-1-(pyridin-4-ylmethyl)-3H-thieno[2,3-e][1,4]diazepin-2-one

Systemtic Name: 6,7-dimethyl-5-phenyl-1-(pyridin-4-ylmethyl)-3H-thieno[2,3-e][1,4]diazepin-2-one Openeye Name: 6,7-dimethyl-5-phenyl-1-(4-pyridylmethyl)-3H-thieno[2,3-e][1,4]diazepin-2-one CAS Name: 6,7-dimethyl-5-phenyl-1-(pyridin-4-ylmethyl)-3H-thieno[2,3-e][1,4]diazepin-2-one IUPAC Name: 6,7-dimethyl-5-phenyl-1-(pyridin-4-ylmethyl)-3H-thieno[2,3-e][1,4]diazepin-2-one Traditional Name: 6,7-dimethyl-5-phenyl-1-(4-pyridylmethyl)-3H-thieno[2,3-e][1,4]diazepin-2-one Formula: C21H19N3OS MolecularWeight: 361.46006

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=NCC(=O)N2CC3=CC=NC=C3)C4=CC=CC=C4)C

Isomeric SMILES

CC1=C(SC2=C1C(=NCC(=O)N2CC3=CC=NC=C3)C4=CC=CC=C4)C

InChI

InChI=1S/C21H19N3OS/c1-14-15(2)26-21-19(14)20(17-6-4-3-5-7-17)23-12-18(25)24(21)13-16-8-10-22-11-9-16/h3-11H,12-13H2,1-2H3