3-[(6-methoxy-1H-benzimidazol-2-yl)sulfanyl]-1,3,4,5-tetrahydro-1-benzazepin-2-one

Systemtic Name: 3-[(6-methoxy-1H-benzimidazol-2-yl)sulfanyl]-1,3,4,5-tetrahydro-1-benzazepin-2-one Openeye Name: 3-[(6-methoxy-1H-benzimidazol-2-yl)sulfanyl]-1,3,4,5-tetrahydro-1-benzazepin-2-one CAS Name: 3-[(6-methoxy-1H-benzimidazol-2-yl)thio]-1,3,4,5-tetrahydro-1-benzazepin-2-one IUPAC Name: 3-[(6-methoxy-1H-benzimidazol-2-yl)sulfanyl]-1,3,4,5-tetrahydro-1-benzazepin-2-one Traditional Name: 3-[(6-methoxy-1H-benzimidazol-2-yl)thio]-1,3,4,5-tetrahydro-1-benzazepin-2-one Formula: C18H17N3O2S MolecularWeight: 339.41148

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N=C(N2)SC3CCC4=CC=CC=C4NC3=O

Isomeric SMILES

COC1=CC2=C(C=C1)N=C(N2)SC3CCC4=CC=CC=C4NC3=O

InChI

InChI=1S/C18H17N3O2S/c1-23-12-7-8-14-15(10-12)21-18(20-14)24-16-9-6-11-4-2-3-5-13(11)19-17(16)22/h2-5,7-8,10,16H,6,9H2,1H3,(H,19,22)(H,20,21)