N,1-dimethyl-5-(2-methylsulfanylethylamino)-N-(phenylmethyl)-4,5,6,7-tetrahydroindazole-3-carboxamide

Systemtic Name: N,1-dimethyl-5-(2-methylsulfanylethylamino)-N-(phenylmethyl)-4,5,6,7-tetrahydroindazole-3-carboxamide Openeye Name: N-benzyl-N,1-dimethyl-5-(2-methylsulfanylethylamino)-4,5,6,7-tetrahydroindazole-3-carboxamide CAS Name: N,1-dimethyl-5-[2-(methylthio)ethylamino]-N-(phenylmethyl)-4,5,6,7-tetrahydroindazole-3-carboxamide IUPAC Name: N-benzyl-N,1-dimethyl-5-(2-methylsulfanylethylamino)-4,5,6,7-tetrahydroindazole-3-carboxamide Traditional Name: N-benzyl-N,1-dimethyl-5-[2-(methylthio)ethylamino]-4,5,6,7-tetrahydroindazole-3-carboxamide Formula: C20H28N4OS MolecularWeight: 372.52752

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(CC(CC2)NCCSC)C(=N1)C(=O)N(C)CC3=CC=CC=C3

Isomeric SMILES

CN1C2=C(CC(CC2)NCCSC)C(=N1)C(=O)N(C)CC3=CC=CC=C3

InChI

InChI=1S/C20H28N4OS/c1-23(14-15-7-5-4-6-8-15)20(25)19-17-13-16(21-11-12-26-3)9-10-18(17)24(2)22-19/h4-8,16,21H,9-14H2,1-3H3