N-[[5-(dimethylamino)-2-[(4-dimethylaminophenyl)-phenyl-methyl]-4-methyl-phenyl]carbamothioyl]dodecanamide

Systemtic Name: N-[[5-(dimethylamino)-2-[(4-dimethylaminophenyl)-phenyl-methyl]-4-methyl-phenyl]carbamothioyl]dodecanamide Openeye Name: N-[[5-(dimethylamino)-2-[(4-dimethylaminophenyl)-phenyl-methyl]-4-methyl-phenyl]carbamothioyl]dodecanamide CAS Name: N-[[5-(dimethylamino)-2-[(4-dimethylaminophenyl)-phenylmethyl]-4-methylanilino]-sulfanylidenemethyl]dodecanamide IUPAC Name: N-[[5-(dimethylamino)-2-[(4-dimethylaminophenyl)-phenylmethyl]-4-methylphenyl]carbamothioyl]dodecanamide Traditional Name: N-[[5-(dimethylamino)-2-[(4-dimethylaminophenyl)-phenyl-methyl]-4-methyl-phenyl]thiocarbamoyl]lauramide Formula: C37H52N4OS MolecularWeight: 600.89998

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)NC(=S)NC1=C(C=C(C(=C1)N(C)C)C)C(C2=CC=CC=C2)C3=CC=C(C=C3)N(C)C

Isomeric SMILES

CCCCCCCCCCCC(=O)NC(=S)NC1=C(C=C(C(=C1)N(C)C)C)C(C2=CC=CC=C2)C3=CC=C(C=C3)N(C)C

InChI

InChI=1S/C37H52N4OS/c1-7-8-9-10-11-12-13-14-18-21-35(42)39-37(43)38-33-27-34(41(5)6)28(2)26-32(33)36(29-19-16-15-17-20-29)30-22-24-31(25-23-30)40(3)4/h15-17,19-20,22-27,36H,7-14,18,21H2,1-6H3,(H2,38,39,42,43)