3-[2-[(4-methoxyphenyl)carbamoylamino]-1,3-thiazol-4-yl]-N-(3-methylsulfanylphenyl)propanamide

Systemtic Name: 3-[2-[(4-methoxyphenyl)carbamoylamino]-1,3-thiazol-4-yl]-N-(3-methylsulfanylphenyl)propanamide Openeye Name: 3-[2-[(4-methoxyphenyl)carbamoylamino]thiazol-4-yl]-N-(3-methylsulfanylphenyl)propanamide CAS Name: 3-[2-[[(4-methoxyanilino)-oxomethyl]amino]-4-thiazolyl]-N-[3-(methylthio)phenyl]propanamide IUPAC Name: 3-[2-[(4-methoxyphenyl)carbamoylamino]-1,3-thiazol-4-yl]-N-(3-methylsulfanylphenyl)propanamide Traditional Name: 3-[2-[(4-methoxyphenyl)carbamoylamino]thiazol-4-yl]-N-[3-(methylthio)phenyl]propionamide Formula: C21H22N4O3S2 MolecularWeight: 442.55438

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)NC2=NC(=CS2)CCC(=O)NC3=CC(=CC=C3)SC

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)NC2=NC(=CS2)CCC(=O)NC3=CC(=CC=C3)SC

InChI

InChI=1S/C21H22N4O3S2/c1-28-17-9-6-14(7-10-17)23-20(27)25-21-24-16(13-30-21)8-11-19(26)22-15-4-3-5-18(12-15)29-2/h3-7,9-10,12-13H,8,11H2,1-2H3,(H,22,26)(H2,23,24,25,27)