1-(3-chloranyl-2-methyl-phenyl)-3-[(4-propan-2-ylphenyl)carbamothioylamino]thiourea

Systemtic Name: 1-(3-chloranyl-2-methyl-phenyl)-3-[(4-propan-2-ylphenyl)carbamothioylamino]thiourea Openeye Name: 1-(3-chloro-2-methyl-phenyl)-3-[(4-isopropylphenyl)carbamothioylamino]thiourea CAS Name: 1-[[(3-chloro-2-methylanilino)-sulfanylidenemethyl]amino]-3-(4-propan-2-ylphenyl)thiourea IUPAC Name: 1-(3-chloro-2-methylphenyl)-3-[(4-propan-2-ylphenyl)carbamothioylamino]thiourea Traditional Name: 1-(3-chloro-2-methyl-phenyl)-3-(p-cumenylthiocarbamoylamino)thiourea Formula: C18H21ClN4S2 MolecularWeight: 392.96914

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NC(=S)NNC(=S)NC2=CC=C(C=C2)C(C)C

Isomeric SMILES

CC1=C(C=CC=C1Cl)NC(=S)NNC(=S)NC2=CC=C(C=C2)C(C)C

InChI

InChI=1S/C18H21ClN4S2/c1-11(2)13-7-9-14(10-8-13)20-17(24)22-23-18(25)21-16-6-4-5-15(19)12(16)3/h4-11H,1-3H3,(H2,20,22,24)(H2,21,23,25)