3-[(4-methyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]-1,3,4,5-tetrahydro-1-benzazepin-2-one

Systemtic Name: 3-[(4-methyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]-1,3,4,5-tetrahydro-1-benzazepin-2-one Openeye Name: 3-[(4-methyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]-1,3,4,5-tetrahydro-1-benzazepin-2-one CAS Name: 3-[(4-methyl-5-phenyl-1,2,4-triazol-3-yl)thio]-1,3,4,5-tetrahydro-1-benzazepin-2-one IUPAC Name: 3-[(4-methyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]-1,3,4,5-tetrahydro-1-benzazepin-2-one Traditional Name: 3-[(4-methyl-5-phenyl-1,2,4-triazol-3-yl)thio]-1,3,4,5-tetrahydro-1-benzazepin-2-one Formula: C19H18N4OS MolecularWeight: 350.43742

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SC2CCC3=CC=CC=C3NC2=O)C4=CC=CC=C4

Isomeric SMILES

CN1C(=NN=C1SC2CCC3=CC=CC=C3NC2=O)C4=CC=CC=C4

InChI

InChI=1S/C19H18N4OS/c1-23-17(14-8-3-2-4-9-14)21-22-19(23)25-16-12-11-13-7-5-6-10-15(13)20-18(16)24/h2-10,16H,11-12H2,1H3,(H,20,24)