1-(3-methylbutyl)-3-[[4-oxidanylidene-4-(4-phenylphenyl)butanoyl]amino]thiourea

Systemtic Name: 1-(3-methylbutyl)-3-[[4-oxidanylidene-4-(4-phenylphenyl)butanoyl]amino]thiourea Openeye Name: 1-isopentyl-3-[[4-oxo-4-(4-phenylphenyl)butanoyl]amino]thiourea CAS Name: 1-[[1,4-dioxo-4-(4-phenylphenyl)butyl]amino]-3-(3-methylbutyl)thiourea IUPAC Name: 1-(3-methylbutyl)-3-[[4-oxo-4-(4-phenylphenyl)butanoyl]amino]thiourea Traditional Name: 1-isoamyl-3-[[4-keto-4-(4-phenylphenyl)butanoyl]amino]thiourea Formula: C22H27N3O2S MolecularWeight: 397.53368

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H27N3O2S/c1-16(2)14-15-23-22(28)25-24-21(27)13-12-20(26)19-10-8-18(9-11-19)17-6-4-3-5-7-17/h3-11,16H,12-15H2,1-2H3,(H,24,27)(H2,23,25,28)