1-[[4-(2,5-dimethylphenyl)-4-oxidanylidene-butanoyl]amino]-3-phenyl-thiourea

Systemtic Name: 1-[[4-(2,5-dimethylphenyl)-4-oxidanylidene-butanoyl]amino]-3-phenyl-thiourea Openeye Name: 1-[[4-(2,5-dimethylphenyl)-4-oxo-butanoyl]amino]-3-phenyl-thiourea CAS Name: 1-[[4-(2,5-dimethylphenyl)-1,4-dioxobutyl]amino]-3-phenylthiourea IUPAC Name: 1-[[4-(2,5-dimethylphenyl)-4-oxobutanoyl]amino]-3-phenylthiourea Traditional Name: 1-[[4-(2,5-dimethylphenyl)-4-keto-butanoyl]amino]-3-phenyl-thiourea Formula: C19H21N3O2S MolecularWeight: 355.45394

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C(=O)CCC(=O)NNC(=S)NC2=CC=CC=C2

Isomeric SMILES

CC1=CC(=C(C=C1)C)C(=O)CCC(=O)NNC(=S)NC2=CC=CC=C2

InChI

InChI=1S/C19H21N3O2S/c1-13-8-9-14(2)16(12-13)17(23)10-11-18(24)21-22-19(25)20-15-6-4-3-5-7-15/h3-9,12H,10-11H2,1-2H3,(H,21,24)(H2,20,22,25)