1-[(E)-[4-(4-chlorophenyl)sulfanyl-4-phenyl-butan-2-ylidene]amino]thiourea

Systemtic Name: 1-[(E)-[4-(4-chlorophenyl)sulfanyl-4-phenyl-butan-2-ylidene]amino]thiourea Openeye Name: [(E)-[3-(4-chlorophenyl)sulfanyl-1-methyl-3-phenyl-propylidene]amino]thiourea CAS Name: [(E)-[4-[(4-chlorophenyl)thio]-4-phenylbutan-2-ylidene]amino]thiourea IUPAC Name: [(E)-[4-(4-chlorophenyl)sulfanyl-4-phenylbutan-2-ylidene]amino]thiourea Traditional Name: [(E)-[3-[(4-chlorophenyl)thio]-1-methyl-3-phenyl-propylidene]amino]thiourea Formula: C17H18ClN3S2 MolecularWeight: 363.92792

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=S)N)CC(C1=CC=CC=C1)SC2=CC=C(C=C2)Cl

Isomeric SMILES

C/C(=N\NC(=S)N)/CC(C1=CC=CC=C1)SC2=CC=C(C=C2)Cl

InChI

InChI=1S/C17H18ClN3S2/c1-12(20-21-17(19)22)11-16(13-5-3-2-4-6-13)23-15-9-7-14(18)8-10-15/h2-10,16H,11H2,1H3,(H3,19,21,22)/b20-12+