3-(2-chloranyl-5-nitro-phenyl)-1-cyclopropyl-1-[(4-methoxyphenyl)methyl]thiourea

Systemtic Name: 3-(2-chloranyl-5-nitro-phenyl)-1-cyclopropyl-1-[(4-methoxyphenyl)methyl]thiourea Openeye Name: 3-(2-chloro-5-nitro-phenyl)-1-cyclopropyl-1-[(4-methoxyphenyl)methyl]thiourea CAS Name: 3-(2-chloro-5-nitrophenyl)-1-cyclopropyl-1-[(4-methoxyphenyl)methyl]thiourea IUPAC Name: 3-(2-chloro-5-nitrophenyl)-1-cyclopropyl-1-[(4-methoxyphenyl)methyl]thiourea Traditional Name: 3-(2-chloro-5-nitro-phenyl)-1-cyclopropyl-1-p-anisyl-thiourea Formula: C18H18ClN3O3S MolecularWeight: 391.87182

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN(C2CC2)C(=S)NC3=C(C=CC(=C3)[N+](=O)[O-])Cl

Isomeric SMILES

COC1=CC=C(C=C1)CN(C2CC2)C(=S)NC3=C(C=CC(=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C18H18ClN3O3S/c1-25-15-7-2-12(3-8-15)11-21(13-4-5-13)18(26)20-17-10-14(22(23)24)6-9-16(17)19/h2-3,6-10,13H,4-5,11H2,1H3,(H,20,26)