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

Systemtic Name: 3-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanyl]-1,3,4,5-tetrahydro-1-benzazepin-2-one Openeye Name: 3-(1-phenyltetrazol-5-yl)sulfanyl-1,3,4,5-tetrahydro-1-benzazepin-2-one CAS Name: 3-[(1-phenyl-5-tetrazolyl)thio]-1,3,4,5-tetrahydro-1-benzazepin-2-one IUPAC Name: 3-(1-phenyltetrazol-5-yl)sulfanyl-1,3,4,5-tetrahydro-1-benzazepin-2-one Traditional Name: 3-[(1-phenyltetrazol-5-yl)thio]-1,3,4,5-tetrahydro-1-benzazepin-2-one Formula: C17H15N5OS MolecularWeight: 337.3989

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=CC=CC=C2NC(=O)C1SC3=NN=NN3C4=CC=CC=C4

Isomeric SMILES

C1CC2=CC=CC=C2NC(=O)C1SC3=NN=NN3C4=CC=CC=C4

InChI

InChI=1S/C17H15N5OS/c23-16-15(11-10-12-6-4-5-9-14(12)18-16)24-17-19-20-21-22(17)13-7-2-1-3-8-13/h1-9,15H,10-11H2,(H,18,23)