1-[4-(4-chlorophenyl)sulfanylbutanoylamino]-3-ethyl-thiourea

Systemtic Name: 1-[4-(4-chlorophenyl)sulfanylbutanoylamino]-3-ethyl-thiourea Openeye Name: 1-[4-(4-chlorophenyl)sulfanylbutanoylamino]-3-ethyl-thiourea CAS Name: 1-[[4-[(4-chlorophenyl)thio]-1-oxobutyl]amino]-3-ethylthiourea IUPAC Name: 1-[4-(4-chlorophenyl)sulfanylbutanoylamino]-3-ethylthiourea Traditional Name: 1-[4-[(4-chlorophenyl)thio]butanoylamino]-3-ethyl-thiourea Formula: C13H18ClN3OS2 MolecularWeight: 331.88452

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=S)NNC(=O)CCCSC1=CC=C(C=C1)Cl

Isomeric SMILES

CCNC(=S)NNC(=O)CCCSC1=CC=C(C=C1)Cl

InChI

InChI=1S/C13H18ClN3OS2/c1-2-15-13(19)17-16-12(18)4-3-9-20-11-7-5-10(14)6-8-11/h5-8H,2-4,9H2,1H3,(H,16,18)(H2,15,17,19)