1-[2-chloranyl-4-[[3-chloranyl-4-(methylcarbamothioylamino)phenyl]methyl]phenyl]-3-methyl-thiourea

Systemtic Name: 1-[2-chloranyl-4-[[3-chloranyl-4-(methylcarbamothioylamino)phenyl]methyl]phenyl]-3-methyl-thiourea Openeye Name: 1-[2-chloro-4-[[3-chloro-4-(methylcarbamothioylamino)phenyl]methyl]phenyl]-3-methyl-thiourea CAS Name: 1-[2-chloro-4-[[3-chloro-4-[[methylamino(sulfanylidene)methyl]amino]phenyl]methyl]phenyl]-3-methylthiourea IUPAC Name: 1-[2-chloro-4-[[3-chloro-4-(methylcarbamothioylamino)phenyl]methyl]phenyl]-3-methylthiourea Traditional Name: 1-[2-chloro-4-[3-chloro-4-(methylthiocarbamoylamino)benzyl]phenyl]-3-methyl-thiourea Formula: C17H18Cl2N4S2 MolecularWeight: 413.38762

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=S)NC1=C(C=C(C=C1)CC2=CC(=C(C=C2)NC(=S)NC)Cl)Cl

Isomeric SMILES

CNC(=S)NC1=C(C=C(C=C1)CC2=CC(=C(C=C2)NC(=S)NC)Cl)Cl

InChI

InChI=1S/C17H18Cl2N4S2/c1-20-16(24)22-14-5-3-10(8-12(14)18)7-11-4-6-15(13(19)9-11)23-17(25)21-2/h3-6,8-9H,7H2,1-2H3,(H2,20,22,24)(H2,21,23,25)