4-[[(4-butylphenyl)carbamothioyl-methyl-amino]methyl]-N-methyl-benzamide

Systemtic Name: 4-[[(4-butylphenyl)carbamothioyl-methyl-amino]methyl]-N-methyl-benzamide Openeye Name: 4-[[(4-butylphenyl)carbamothioyl-methyl-amino]methyl]-N-methyl-benzamide CAS Name: 4-[[[(4-butylanilino)-sulfanylidenemethyl]-methylamino]methyl]-N-methylbenzamide IUPAC Name: 4-[[(4-butylphenyl)carbamothioyl-methylamino]methyl]-N-methylbenzamide Traditional Name: 4-[[(4-butylphenyl)thiocarbamoyl-methyl-amino]methyl]-N-methyl-benzamide Formula: C21H27N3OS MolecularWeight: 369.52358

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=S)N(C)CC2=CC=C(C=C2)C(=O)NC

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=S)N(C)CC2=CC=C(C=C2)C(=O)NC

InChI

InChI=1S/C21H27N3OS/c1-4-5-6-16-9-13-19(14-10-16)23-21(26)24(3)15-17-7-11-18(12-8-17)20(25)22-2/h7-14H,4-6,15H2,1-3H3,(H,22,25)(H,23,26)