(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-(1-phenyl-1,2,3-triazol-4-yl)methanone

Systemtic Name: (2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-(1-phenyl-1,2,3-triazol-4-yl)methanone Openeye Name: (2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-(1-phenyltriazol-4-yl)methanone CAS Name: (2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-(1-phenyl-4-triazolyl)methanone IUPAC Name: (2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-(1-phenyltriazol-4-yl)methanone Traditional Name: (2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-(1-phenyltriazol-4-yl)methanone Formula: C19H18N4OS MolecularWeight: 350.43742

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(C2=CC=CC=C2S1)C(=O)C3=CN(N=N3)C4=CC=CC=C4

Isomeric SMILES

CC1CCN(C2=CC=CC=C2S1)C(=O)C3=CN(N=N3)C4=CC=CC=C4

InChI

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