4,6-dimethyl-1-[[4-[(4-propan-2-ylphenyl)methyl]piperazin-1-yl]methyl]-2-sulfanylidene-pyridine-3-carboxamide

Systemtic Name: 4,6-dimethyl-1-[[4-[(4-propan-2-ylphenyl)methyl]piperazin-1-yl]methyl]-2-sulfanylidene-pyridine-3-carboxamide Openeye Name: 1-[[4-[(4-isopropylphenyl)methyl]piperazin-1-yl]methyl]-4,6-dimethyl-2-thioxo-pyridine-3-carboxamide CAS Name: 4,6-dimethyl-1-[[4-[(4-propan-2-ylphenyl)methyl]-1-piperazinyl]methyl]-2-sulfanylidene-3-pyridinecarboxamide IUPAC Name: 4,6-dimethyl-1-[[4-[(4-propan-2-ylphenyl)methyl]piperazin-1-yl]methyl]-2-sulfanylidenepyridine-3-carboxamide Traditional Name: 1-[[4-(4-isopropylbenzyl)piperazino]methyl]-4,6-dimethyl-2-thioxo-nicotinamide Formula: C23H32N4OS MolecularWeight: 412.59138

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=S)N1CN2CCN(CC2)CC3=CC=C(C=C3)C(C)C)C(=O)N)C

Isomeric SMILES

CC1=CC(=C(C(=S)N1CN2CCN(CC2)CC3=CC=C(C=C3)C(C)C)C(=O)N)C

InChI

InChI=1S/C23H32N4OS/c1-16(2)20-7-5-19(6-8-20)14-25-9-11-26(12-10-25)15-27-18(4)13-17(3)21(22(24)28)23(27)29/h5-8,13,16H,9-12,14-15H2,1-4H3,(H2,24,28)