1-[4,5-dimethyl-2-(phenylcarbamothioylamino)phenyl]-3-phenyl-thiourea

Systemtic Name: 1-[4,5-dimethyl-2-(phenylcarbamothioylamino)phenyl]-3-phenyl-thiourea Openeye Name: 1-[4,5-dimethyl-2-(phenylcarbamothioylamino)phenyl]-3-phenyl-thiourea CAS Name: 1-[2-[[anilino(sulfanylidene)methyl]amino]-4,5-dimethylphenyl]-3-phenylthiourea IUPAC Name: 1-[4,5-dimethyl-2-(phenylcarbamothioylamino)phenyl]-3-phenylthiourea Traditional Name: 1-[4,5-dimethyl-2-(phenylthiocarbamoylamino)phenyl]-3-phenyl-thiourea Formula: C22H22N4S2 MolecularWeight: 406.56688

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C)NC(=S)NC2=CC=CC=C2)NC(=S)NC3=CC=CC=C3

Isomeric SMILES

CC1=CC(=C(C=C1C)NC(=S)NC2=CC=CC=C2)NC(=S)NC3=CC=CC=C3

InChI

InChI=1S/C22H22N4S2/c1-15-13-19(25-21(27)23-17-9-5-3-6-10-17)20(14-16(15)2)26-22(28)24-18-11-7-4-8-12-18/h3-14H,1-2H3,(H2,23,25,27)(H2,24,26,28)