1-(4-methylphenyl)-3-[(3R)-1-[(4-methylphenyl)carbamothioylamino]pentan-3-yl]thiourea

Systemtic Name: 1-(4-methylphenyl)-3-[(3R)-1-[(4-methylphenyl)carbamothioylamino]pentan-3-yl]thiourea Openeye Name: 1-[(1R)-1-ethyl-3-(p-tolylcarbamothioylamino)propyl]-3-(p-tolyl)thiourea CAS Name: 1-[(3R)-1-[[(4-methylanilino)-sulfanylidenemethyl]amino]pentan-3-yl]-3-(4-methylphenyl)thiourea IUPAC Name: 1-(4-methylphenyl)-3-[(3R)-1-[(4-methylphenyl)carbamothioylamino]pentan-3-yl]thiourea Traditional Name: 1-[(1R)-1-ethyl-3-(p-tolylthiocarbamoylamino)propyl]-3-(p-tolyl)thiourea Formula: C21H28N4S2 MolecularWeight: 400.60382

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CCNC(=S)NC1=CC=C(C=C1)C)NC(=S)NC2=CC=C(C=C2)C

Isomeric SMILES

CC[C@H](CCNC(=S)NC1=CC=C(C=C1)C)NC(=S)NC2=CC=C(C=C2)C

InChI

InChI=1S/C21H28N4S2/c1-4-17(23-21(27)25-19-11-7-16(3)8-12-19)13-14-22-20(26)24-18-9-5-15(2)6-10-18/h5-12,17H,4,13-14H2,1-3H3,(H2,22,24,26)(H2,23,25,27)/t17-/m1/s1