1-[2-(3,4-dimethoxyphenyl)ethyl]-3-[(4-oxidanylidene-4-thiophen-2-yl-butanoyl)amino]thiourea

Systemtic Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-[(4-oxidanylidene-4-thiophen-2-yl-butanoyl)amino]thiourea Openeye Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-[[4-oxo-4-(2-thienyl)butanoyl]amino]thiourea CAS Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-[(1,4-dioxo-4-thiophen-2-ylbutyl)amino]thiourea IUPAC Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-[(4-oxo-4-thiophen-2-ylbutanoyl)amino]thiourea Traditional Name: 1-homoveratryl-3-[[4-keto-4-(2-thienyl)butanoyl]amino]thiourea Formula: C19H23N3O4S2 MolecularWeight: 421.53362

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=S)NNC(=O)CCC(=O)C2=CC=CS2)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=S)NNC(=O)CCC(=O)C2=CC=CS2)OC

InChI

InChI=1S/C19H23N3O4S2/c1-25-15-7-5-13(12-16(15)26-2)9-10-20-19(27)22-21-18(24)8-6-14(23)17-4-3-11-28-17/h3-5,7,11-12H,6,8-10H2,1-2H3,(H,21,24)(H2,20,22,27)