N-[(5,6-dimethyl-1,2,4-triazin-3-yl)methylsulfanyl]-1-(2-methylpropyl)-N-phenyl-2,3-dihydro-1-benzazepine-4-carboxamide

Systemtic Name: N-[(5,6-dimethyl-1,2,4-triazin-3-yl)methylsulfanyl]-1-(2-methylpropyl)-N-phenyl-2,3-dihydro-1-benzazepine-4-carboxamide Openeye Name: N-[(5,6-dimethyl-1,2,4-triazin-3-yl)methylsulfanyl]-1-isobutyl-N-phenyl-2,3-dihydro-1-benzazepine-4-carboxamide CAS Name: N-[(5,6-dimethyl-1,2,4-triazin-3-yl)methylthio]-1-(2-methylpropyl)-N-phenyl-2,3-dihydro-1-benzazepine-4-carboxamide IUPAC Name: N-[(5,6-dimethyl-1,2,4-triazin-3-yl)methylsulfanyl]-1-(2-methylpropyl)-N-phenyl-2,3-dihydro-1-benzazepine-4-carboxamide Traditional Name: N-[(5,6-dimethyl-1,2,4-triazin-3-yl)methylthio]-1-isobutyl-N-phenyl-2,3-dihydro-1-benzazepine-4-carboxamide Formula: C27H31N5OS MolecularWeight: 473.63294

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=NC(=N1)CSN(C2=CC=CC=C2)C(=O)C3=CC4=CC=CC=C4N(CC3)CC(C)C)C

Isomeric SMILES

CC1=C(N=NC(=N1)CSN(C2=CC=CC=C2)C(=O)C3=CC4=CC=CC=C4N(CC3)CC(C)C)C

InChI

InChI=1S/C27H31N5OS/c1-19(2)17-31-15-14-23(16-22-10-8-9-13-25(22)31)27(33)32(24-11-6-5-7-12-24)34-18-26-28-20(3)21(4)29-30-26/h5-13,16,19H,14-15,17-18H2,1-4H3