1-(2-ethyl-6-methyl-phenyl)-3-[(4-oxidanylidene-4-thiophen-2-yl-butanoyl)amino]thiourea

Systemtic Name: 1-(2-ethyl-6-methyl-phenyl)-3-[(4-oxidanylidene-4-thiophen-2-yl-butanoyl)amino]thiourea Openeye Name: 1-(2-ethyl-6-methyl-phenyl)-3-[[4-oxo-4-(2-thienyl)butanoyl]amino]thiourea CAS Name: 1-[(1,4-dioxo-4-thiophen-2-ylbutyl)amino]-3-(2-ethyl-6-methylphenyl)thiourea IUPAC Name: 1-(2-ethyl-6-methylphenyl)-3-[(4-oxo-4-thiophen-2-ylbutanoyl)amino]thiourea Traditional Name: 1-(2-ethyl-6-methyl-phenyl)-3-[[4-keto-4-(2-thienyl)butanoyl]amino]thiourea Formula: C18H21N3O2S2 MolecularWeight: 375.50824

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=S)NNC(=O)CCC(=O)C2=CC=CS2)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=S)NNC(=O)CCC(=O)C2=CC=CS2)C

InChI

InChI=1S/C18H21N3O2S2/c1-3-13-7-4-6-12(2)17(13)19-18(24)21-20-16(23)10-9-14(22)15-8-5-11-25-15/h4-8,11H,3,9-10H2,1-2H3,(H,20,23)(H2,19,21,24)