1-(4-butylphenyl)-3-[(4-ethoxyphenyl)carbamothioylamino]thiourea

Systemtic Name: 1-(4-butylphenyl)-3-[(4-ethoxyphenyl)carbamothioylamino]thiourea Openeye Name: 1-(4-butylphenyl)-3-[(4-ethoxyphenyl)carbamothioylamino]thiourea CAS Name: 1-[[(4-butylanilino)-sulfanylidenemethyl]amino]-3-(4-ethoxyphenyl)thiourea IUPAC Name: 1-(4-butylphenyl)-3-[(4-ethoxyphenyl)carbamothioylamino]thiourea Traditional Name: 1-(4-butylphenyl)-3-(p-phenetylthiocarbamoylamino)thiourea Formula: C20H26N4OS2 MolecularWeight: 402.57664

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H26N4OS2/c1-3-5-6-15-7-9-16(10-8-15)21-19(26)23-24-20(27)22-17-11-13-18(14-12-17)25-4-2/h7-14H,3-6H2,1-2H3,(H2,21,23,26)(H2,22,24,27)