1-(3-chloranyl-2-methyl-phenyl)-3-[3-(dimethylamino)propylcarbamothioylamino]thiourea

Systemtic Name: 1-(3-chloranyl-2-methyl-phenyl)-3-[3-(dimethylamino)propylcarbamothioylamino]thiourea Openeye Name: 1-(3-chloro-2-methyl-phenyl)-3-[3-(dimethylamino)propylcarbamothioylamino]thiourea CAS Name: 1-[[(3-chloro-2-methylanilino)-sulfanylidenemethyl]amino]-3-[3-(dimethylamino)propyl]thiourea IUPAC Name: 1-(3-chloro-2-methylphenyl)-3-[3-(dimethylamino)propylcarbamothioylamino]thiourea Traditional Name: 1-(3-chloro-2-methyl-phenyl)-3-[3-(dimethylamino)propylthiocarbamoylamino]thiourea Formula: C14H22ClN5S2 MolecularWeight: 359.94098

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NC(=S)NNC(=S)NCCCN(C)C

Isomeric SMILES

CC1=C(C=CC=C1Cl)NC(=S)NNC(=S)NCCCN(C)C

InChI

InChI=1S/C14H22ClN5S2/c1-10-11(15)6-4-7-12(10)17-14(22)19-18-13(21)16-8-5-9-20(2)3/h4,6-7H,5,8-9H2,1-3H3,(H2,16,18,21)(H2,17,19,22)