1-(3-chloranyl-2-methyl-phenyl)-3-(3-ethoxypropylcarbamothioylamino)thiourea

Systemtic Name: 1-(3-chloranyl-2-methyl-phenyl)-3-(3-ethoxypropylcarbamothioylamino)thiourea Openeye Name: 1-(3-chloro-2-methyl-phenyl)-3-(3-ethoxypropylcarbamothioylamino)thiourea CAS Name: 1-[[(3-chloro-2-methylanilino)-sulfanylidenemethyl]amino]-3-(3-ethoxypropyl)thiourea IUPAC Name: 1-(3-chloro-2-methylphenyl)-3-(3-ethoxypropylcarbamothioylamino)thiourea Traditional Name: 1-(3-chloro-2-methyl-phenyl)-3-(3-ethoxypropylthiocarbamoylamino)thiourea Formula: C14H21ClN4OS2 MolecularWeight: 360.92574

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCCNC(=S)NNC(=S)NC1=C(C(=CC=C1)Cl)C

Isomeric SMILES

CCOCCCNC(=S)NNC(=S)NC1=C(C(=CC=C1)Cl)C

InChI

InChI=1S/C14H21ClN4OS2/c1-3-20-9-5-8-16-13(21)18-19-14(22)17-12-7-4-6-11(15)10(12)2/h4,6-7H,3,5,8-9H2,1-2H3,(H2,16,18,21)(H2,17,19,22)