1-butyl-3-[(3-methoxyphenyl)carbamothioylamino]thiourea

Systemtic Name: 1-butyl-3-[(3-methoxyphenyl)carbamothioylamino]thiourea Openeye Name: 1-butyl-3-[(3-methoxyphenyl)carbamothioylamino]thiourea CAS Name: 1-butyl-3-[[(3-methoxyanilino)-sulfanylidenemethyl]amino]thiourea IUPAC Name: 1-butyl-3-[(3-methoxyphenyl)carbamothioylamino]thiourea Traditional Name: 1-butyl-3-[(3-methoxyphenyl)thiocarbamoylamino]thiourea Formula: C13H20N4OS2 MolecularWeight: 312.4541

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=S)NNC(=S)NC1=CC(=CC=C1)OC

Isomeric SMILES

CCCCNC(=S)NNC(=S)NC1=CC(=CC=C1)OC

InChI

InChI=1S/C13H20N4OS2/c1-3-4-8-14-12(19)16-17-13(20)15-10-6-5-7-11(9-10)18-2/h5-7,9H,3-4,8H2,1-2H3,(H2,14,16,19)(H2,15,17,20)