N-[4-[(4-ethylphenyl)carbamothioylamino]-2,5-dimethoxy-phenyl]-2-methyl-propanamide

Systemtic Name: N-[4-[(4-ethylphenyl)carbamothioylamino]-2,5-dimethoxy-phenyl]-2-methyl-propanamide Openeye Name: N-[4-[(4-ethylphenyl)carbamothioylamino]-2,5-dimethoxy-phenyl]-2-methyl-propanamide CAS Name: N-[4-[[(4-ethylanilino)-sulfanylidenemethyl]amino]-2,5-dimethoxyphenyl]-2-methylpropanamide IUPAC Name: N-[4-[(4-ethylphenyl)carbamothioylamino]-2,5-dimethoxyphenyl]-2-methylpropanamide Traditional Name: N-[4-[(4-ethylphenyl)thiocarbamoylamino]-2,5-dimethoxy-phenyl]-2-methyl-propionamide Formula: C21H27N3O3S MolecularWeight: 401.52238

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=S)NC2=C(C=C(C(=C2)OC)NC(=O)C(C)C)OC

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=S)NC2=C(C=C(C(=C2)OC)NC(=O)C(C)C)OC

InChI

InChI=1S/C21H27N3O3S/c1-6-14-7-9-15(10-8-14)22-21(28)24-17-12-18(26-4)16(11-19(17)27-5)23-20(25)13(2)3/h7-13H,6H2,1-5H3,(H,23,25)(H2,22,24,28)