1-[(5-chloranylthiophen-2-yl)carbonylamino]-3-[2-(3,4-dimethoxyphenyl)ethyl]thiourea

Systemtic Name: 1-[(5-chloranylthiophen-2-yl)carbonylamino]-3-[2-(3,4-dimethoxyphenyl)ethyl]thiourea Openeye Name: 1-[(5-chlorothiophene-2-carbonyl)amino]-3-[2-(3,4-dimethoxyphenyl)ethyl]thiourea CAS Name: 1-[[(5-chloro-2-thiophenyl)-oxomethyl]amino]-3-[2-(3,4-dimethoxyphenyl)ethyl]thiourea IUPAC Name: 1-[(5-chlorothiophene-2-carbonyl)amino]-3-[2-(3,4-dimethoxyphenyl)ethyl]thiourea Traditional Name: 1-[(5-chlorothiophene-2-carbonyl)amino]-3-homoveratryl-thiourea Formula: C16H18ClN3O3S2 MolecularWeight: 399.91542

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=S)NNC(=O)C2=CC=C(S2)Cl)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=S)NNC(=O)C2=CC=C(S2)Cl)OC

InChI

InChI=1S/C16H18ClN3O3S2/c1-22-11-4-3-10(9-12(11)23-2)7-8-18-16(24)20-19-15(21)13-5-6-14(17)25-13/h3-6,9H,7-8H2,1-2H3,(H,19,21)(H2,18,20,24)