1-(4-butylphenyl)-3-[(3,4-dimethylphenyl)carbamothioylamino]thiourea

Systemtic Name: 1-(4-butylphenyl)-3-[(3,4-dimethylphenyl)carbamothioylamino]thiourea Openeye Name: 1-(4-butylphenyl)-3-[(3,4-dimethylphenyl)carbamothioylamino]thiourea CAS Name: 1-[[(4-butylanilino)-sulfanylidenemethyl]amino]-3-(3,4-dimethylphenyl)thiourea IUPAC Name: 1-(4-butylphenyl)-3-[(3,4-dimethylphenyl)carbamothioylamino]thiourea Traditional Name: 1-(4-butylphenyl)-3-[(3,4-dimethylphenyl)thiocarbamoylamino]thiourea Formula: C20H26N4S2 MolecularWeight: 386.57724

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=S)NNC(=S)NC2=CC(=C(C=C2)C)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=S)NNC(=S)NC2=CC(=C(C=C2)C)C

InChI

InChI=1S/C20H26N4S2/c1-4-5-6-16-8-11-17(12-9-16)21-19(25)23-24-20(26)22-18-10-7-14(2)15(3)13-18/h7-13H,4-6H2,1-3H3,(H2,21,23,25)(H2,22,24,26)