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

Systemtic Name: methyl N-[[5-(dimethylamino)-2-[(4-dimethylaminophenyl)-phenyl-methyl]-4-ethoxy-phenyl]carbamothioyl]carbamate Openeye Name: methyl N-[[5-(dimethylamino)-2-[(4-dimethylaminophenyl)-phenyl-methyl]-4-ethoxy-phenyl]carbamothioyl]carbamate CAS Name: N-[[5-(dimethylamino)-2-[(4-dimethylaminophenyl)-phenylmethyl]-4-ethoxyanilino]-sulfanylidenemethyl]carbamic acid methyl ester IUPAC Name: methyl N-[[5-(dimethylamino)-2-[(4-dimethylaminophenyl)-phenylmethyl]-4-ethoxyphenyl]carbamothioyl]carbamate Traditional Name: N-[[5-(dimethylamino)-2-[(4-dimethylaminophenyl)-phenyl-methyl]-4-ethoxy-phenyl]thiocarbamoyl]carbamic acid methyl ester Formula: C28H34N4O3S MolecularWeight: 506.65956

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C(=C1)C(C2=CC=CC=C2)C3=CC=C(C=C3)N(C)C)NC(=S)NC(=O)OC)N(C)C

Isomeric SMILES

CCOC1=C(C=C(C(=C1)C(C2=CC=CC=C2)C3=CC=C(C=C3)N(C)C)NC(=S)NC(=O)OC)N(C)C

InChI

InChI=1S/C28H34N4O3S/c1-7-35-25-17-22(23(18-24(25)32(4)5)29-27(36)30-28(33)34-6)26(19-11-9-8-10-12-19)20-13-15-21(16-14-20)31(2)3/h8-18,26H,7H2,1-6H3,(H2,29,30,33,36)