1-[(E)-[4-(4-methylphenyl)sulfanyl-3-nitro-phenyl]methylideneamino]-3-prop-2-enyl-thiourea

Systemtic Name: 1-[(E)-[4-(4-methylphenyl)sulfanyl-3-nitro-phenyl]methylideneamino]-3-prop-2-enyl-thiourea Openeye Name: 1-allyl-3-[(E)-[3-nitro-4-(p-tolylsulfanyl)phenyl]methyleneamino]thiourea CAS Name: 1-[(E)-[4-[(4-methylphenyl)thio]-3-nitrophenyl]methylideneamino]-3-prop-2-enylthiourea IUPAC Name: 1-[(E)-[4-(4-methylphenyl)sulfanyl-3-nitrophenyl]methylideneamino]-3-prop-2-enylthiourea Traditional Name: 1-allyl-3-[(E)-[3-nitro-4-(p-tolylthio)benzylidene]amino]thiourea Formula: C18H18N4O2S2 MolecularWeight: 386.49112

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC2=C(C=C(C=C2)C=NNC(=S)NCC=C)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)SC2=C(C=C(C=C2)/C=N/NC(=S)NCC=C)[N+](=O)[O-]

InChI

InChI=1S/C18H18N4O2S2/c1-3-10-19-18(25)21-20-12-14-6-9-17(16(11-14)22(23)24)26-15-7-4-13(2)5-8-15/h3-9,11-12H,1,10H2,2H3,(H2,19,21,25)/b20-12+