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

Systemtic Name: 3-[(4-ethyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]-1,3,4,5-tetrahydro-1-benzazepin-2-one Openeye Name: 3-[[4-ethyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]-1,3,4,5-tetrahydro-1-benzazepin-2-one CAS Name: 3-[(4-ethyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)thio]-1,3,4,5-tetrahydro-1-benzazepin-2-one IUPAC Name: 3-[(4-ethyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]-1,3,4,5-tetrahydro-1-benzazepin-2-one Traditional Name: 3-[[4-ethyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]thio]-1,3,4,5-tetrahydro-1-benzazepin-2-one Formula: C19H19N5OS MolecularWeight: 365.45206

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SC2CCC3=CC=CC=C3NC2=O)C4=CC=NC=C4

Isomeric SMILES

CCN1C(=NN=C1SC2CCC3=CC=CC=C3NC2=O)C4=CC=NC=C4

InChI

InChI=1S/C19H19N5OS/c1-2-24-17(14-9-11-20-12-10-14)22-23-19(24)26-16-8-7-13-5-3-4-6-15(13)21-18(16)25/h3-6,9-12,16H,2,7-8H2,1H3,(H,21,25)