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

Systemtic Name: 3-[(5-azanyl-1,3,4-thiadiazol-2-yl)sulfanyl]-1,3,4,5-tetrahydro-1-benzazepin-2-one Openeye Name: 3-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]-1,3,4,5-tetrahydro-1-benzazepin-2-one CAS Name: 3-[(5-amino-1,3,4-thiadiazol-2-yl)thio]-1,3,4,5-tetrahydro-1-benzazepin-2-one IUPAC Name: 3-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]-1,3,4,5-tetrahydro-1-benzazepin-2-one Traditional Name: 3-[(5-amino-1,3,4-thiadiazol-2-yl)thio]-1,3,4,5-tetrahydro-1-benzazepin-2-one Formula: C12H12N4OS2 MolecularWeight: 292.37988

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=CC=CC=C2NC(=O)C1SC3=NN=C(S3)N

Isomeric SMILES

C1CC2=CC=CC=C2NC(=O)C1SC3=NN=C(S3)N

InChI

InChI=1S/C12H12N4OS2/c13-11-15-16-12(19-11)18-9-6-5-7-3-1-2-4-8(7)14-10(9)17/h1-4,9H,5-6H2,(H2,13,15)(H,14,17)