1-(3-chloranyl-4-methyl-phenyl)-3-[2-[(2-nitrophenyl)amino]ethyl]thiourea

Systemtic Name: 1-(3-chloranyl-4-methyl-phenyl)-3-[2-[(2-nitrophenyl)amino]ethyl]thiourea Openeye Name: 1-(3-chloro-4-methyl-phenyl)-3-[2-(2-nitroanilino)ethyl]thiourea CAS Name: 1-(3-chloro-4-methylphenyl)-3-[2-(2-nitroanilino)ethyl]thiourea IUPAC Name: 1-(3-chloro-4-methylphenyl)-3-[2-(2-nitroanilino)ethyl]thiourea Traditional Name: 1-(3-chloro-4-methyl-phenyl)-3-[2-(2-nitroanilino)ethyl]thiourea Formula: C16H17ClN4O2S MolecularWeight: 364.84978

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=S)NCCNC2=CC=CC=C2[N+](=O)[O-])Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=S)NCCNC2=CC=CC=C2[N+](=O)[O-])Cl

InChI

InChI=1S/C16H17ClN4O2S/c1-11-6-7-12(10-13(11)17)20-16(24)19-9-8-18-14-4-2-3-5-15(14)21(22)23/h2-7,10,18H,8-9H2,1H3,(H2,19,20,24)