1-[(3-chloranyl-2-methyl-phenyl)carbamothioylamino]-1-methyl-3-(phenylmethyl)thiourea

Systemtic Name: 1-[(3-chloranyl-2-methyl-phenyl)carbamothioylamino]-1-methyl-3-(phenylmethyl)thiourea Openeye Name: 3-benzyl-1-[(3-chloro-2-methyl-phenyl)carbamothioylamino]-1-methyl-thiourea CAS Name: 1-[[(3-chloro-2-methylanilino)-sulfanylidenemethyl]amino]-1-methyl-3-(phenylmethyl)thiourea IUPAC Name: 3-benzyl-1-[(3-chloro-2-methylphenyl)carbamothioylamino]-1-methylthiourea Traditional Name: 3-benzyl-1-[(3-chloro-2-methyl-phenyl)thiocarbamoylamino]-1-methyl-thiourea Formula: C17H19ClN4S2 MolecularWeight: 378.94256

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NC(=S)NN(C)C(=S)NCC2=CC=CC=C2

Isomeric SMILES

CC1=C(C=CC=C1Cl)NC(=S)NN(C)C(=S)NCC2=CC=CC=C2

InChI

InChI=1S/C17H19ClN4S2/c1-12-14(18)9-6-10-15(12)20-16(23)21-22(2)17(24)19-11-13-7-4-3-5-8-13/h3-10H,11H2,1-2H3,(H,19,24)(H2,20,21,23)