1-(3-methylbutanoylamino)-3-(4-phenylazanylphenyl)thiourea

Systemtic Name: 1-(3-methylbutanoylamino)-3-(4-phenylazanylphenyl)thiourea Openeye Name: 1-(4-anilinophenyl)-3-(3-methylbutanoylamino)thiourea CAS Name: 1-(4-anilinophenyl)-3-[(3-methyl-1-oxobutyl)amino]thiourea IUPAC Name: 1-(4-anilinophenyl)-3-(3-methylbutanoylamino)thiourea Traditional Name: 1-(4-anilinophenyl)-3-(isovalerylamino)thiourea Formula: C18H22N4OS MolecularWeight: 342.45848

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NNC(=S)NC1=CC=C(C=C1)NC2=CC=CC=C2

Isomeric SMILES

CC(C)CC(=O)NNC(=S)NC1=CC=C(C=C1)NC2=CC=CC=C2

InChI

InChI=1S/C18H22N4OS/c1-13(2)12-17(23)21-22-18(24)20-16-10-8-15(9-11-16)19-14-6-4-3-5-7-14/h3-11,13,19H,12H2,1-2H3,(H,21,23)(H2,20,22,24)