1-(4-butylphenyl)-3-[(4-oxidanylidene-4-phenyl-butanoyl)amino]thiourea

Systemtic Name: 1-(4-butylphenyl)-3-[(4-oxidanylidene-4-phenyl-butanoyl)amino]thiourea Openeye Name: 1-(4-butylphenyl)-3-[(4-oxo-4-phenyl-butanoyl)amino]thiourea CAS Name: 1-(4-butylphenyl)-3-[(1,4-dioxo-4-phenylbutyl)amino]thiourea IUPAC Name: 1-(4-butylphenyl)-3-[(4-oxo-4-phenylbutanoyl)amino]thiourea Traditional Name: 1-(4-butylphenyl)-3-[(4-keto-4-phenyl-butanoyl)amino]thiourea Formula: C21H25N3O2S MolecularWeight: 383.5071

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=S)NNC(=O)CCC(=O)C2=CC=CC=C2

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=S)NNC(=O)CCC(=O)C2=CC=CC=C2

InChI

InChI=1S/C21H25N3O2S/c1-2-3-7-16-10-12-18(13-11-16)22-21(27)24-23-20(26)15-14-19(25)17-8-5-4-6-9-17/h4-6,8-13H,2-3,7,14-15H2,1H3,(H,23,26)(H2,22,24,27)