1-(4-butylphenyl)-3-(pentylcarbamothioylamino)thiourea

Systemtic Name: 1-(4-butylphenyl)-3-(pentylcarbamothioylamino)thiourea Openeye Name: 1-(4-butylphenyl)-3-(pentylcarbamothioylamino)thiourea CAS Name: 1-[[(4-butylanilino)-sulfanylidenemethyl]amino]-3-pentylthiourea IUPAC Name: 1-(4-butylphenyl)-3-(pentylcarbamothioylamino)thiourea Traditional Name: 1-amyl-3-[(4-butylphenyl)thiocarbamoylamino]thiourea Formula: C17H28N4S2 MolecularWeight: 352.56102

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=S)NNC(=S)NC1=CC=C(C=C1)CCCC

Isomeric SMILES

CCCCCNC(=S)NNC(=S)NC1=CC=C(C=C1)CCCC

InChI

InChI=1S/C17H28N4S2/c1-3-5-7-13-18-16(22)20-21-17(23)19-15-11-9-14(10-12-15)8-6-4-2/h9-12H,3-8,13H2,1-2H3,(H2,18,20,22)(H2,19,21,23)