3,3,5-trimethyl-5-(4-methylphenyl)-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-4H-2-benzazepin-1-one

Systemtic Name: 3,3,5-trimethyl-5-(4-methylphenyl)-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-4H-2-benzazepin-1-one Openeye Name: 3,3,5-trimethyl-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-5-(p-tolyl)-4H-2-benzazepin-1-one CAS Name: 3,3,5-trimethyl-5-(4-methylphenyl)-2-[[(5-methyl-1,3,4-thiadiazol-2-yl)thio]methyl]-4H-2-benzazepin-1-one IUPAC Name: 3,3,5-trimethyl-5-(4-methylphenyl)-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-4H-2-benzazepin-1-one Traditional Name: 3,3,5-trimethyl-2-[[(5-methyl-1,3,4-thiadiazol-2-yl)thio]methyl]-5-(p-tolyl)-4H-2-benzazepin-1-one Formula: C24H27N3OS2 MolecularWeight: 437.62068

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2(CC(N(C(=O)C3=CC=CC=C32)CSC4=NN=C(S4)C)(C)C)C

Isomeric SMILES

CC1=CC=C(C=C1)C2(CC(N(C(=O)C3=CC=CC=C32)CSC4=NN=C(S4)C)(C)C)C

InChI

InChI=1S/C24H27N3OS2/c1-16-10-12-18(13-11-16)24(5)14-23(3,4)27(15-29-22-26-25-17(2)30-22)21(28)19-8-6-7-9-20(19)24/h6-13H,14-15H2,1-5H3