N-[(1-methyl-1,2,3,4-tetrazol-5-yl)sulfanylmethyl]-N-phenyl-2,3-dihydro-1H-1-benzazepine-4-carboxamide

Systemtic Name: N-[(1-methyl-1,2,3,4-tetrazol-5-yl)sulfanylmethyl]-N-phenyl-2,3-dihydro-1H-1-benzazepine-4-carboxamide Openeye Name: N-[(1-methyltetrazol-5-yl)sulfanylmethyl]-N-phenyl-2,3-dihydro-1H-1-benzazepine-4-carboxamide CAS Name: N-[[(1-methyl-5-tetrazolyl)thio]methyl]-N-phenyl-2,3-dihydro-1H-1-benzazepine-4-carboxamide IUPAC Name: N-[(1-methyltetrazol-5-yl)sulfanylmethyl]-N-phenyl-2,3-dihydro-1H-1-benzazepine-4-carboxamide Traditional Name: N-[[(1-methyltetrazol-5-yl)thio]methyl]-N-phenyl-2,3-dihydro-1H-1-benzazepine-4-carboxamide Formula: C20H20N6OS MolecularWeight: 392.4774

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=N1)SCN(C2=CC=CC=C2)C(=O)C3=CC4=CC=CC=C4NCC3

Isomeric SMILES

CN1C(=NN=N1)SCN(C2=CC=CC=C2)C(=O)C3=CC4=CC=CC=C4NCC3

InChI

InChI=1S/C20H20N6OS/c1-25-20(22-23-24-25)28-14-26(17-8-3-2-4-9-17)19(27)16-11-12-21-18-10-6-5-7-15(18)13-16/h2-10,13,21H,11-12,14H2,1H3