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

Systemtic Name: 1-(2,3-dimethylphenyl)-3-[(4-oxidanylidene-4-thiophen-2-yl-butanoyl)amino]thiourea Openeye Name: 1-(2,3-dimethylphenyl)-3-[[4-oxo-4-(2-thienyl)butanoyl]amino]thiourea CAS Name: 1-(2,3-dimethylphenyl)-3-[(1,4-dioxo-4-thiophen-2-ylbutyl)amino]thiourea IUPAC Name: 1-(2,3-dimethylphenyl)-3-[(4-oxo-4-thiophen-2-ylbutanoyl)amino]thiourea Traditional Name: 1-(2,3-dimethylphenyl)-3-[[4-keto-4-(2-thienyl)butanoyl]amino]thiourea Formula: C17H19N3O2S2 MolecularWeight: 361.48166

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NC(=S)NNC(=O)CCC(=O)C2=CC=CS2)C

Isomeric SMILES

CC1=C(C(=CC=C1)NC(=S)NNC(=O)CCC(=O)C2=CC=CS2)C

InChI

InChI=1S/C17H19N3O2S2/c1-11-5-3-6-13(12(11)2)18-17(23)20-19-16(22)9-8-14(21)15-7-4-10-24-15/h3-7,10H,8-9H2,1-2H3,(H,19,22)(H2,18,20,23)