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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H27N3O2S/c1-2-3-7-16-23-22(28)25-24-21(27)15-14-20(26)19-12-10-18(11-13-19)17-8-5-4-6-9-17/h4-6,8-13H,2-3,7,14-16H2,1H3,(H,24,27)(H2,23,25,28)