1-[[4-(4-chlorophenyl)-1,3-thiazol-2-yl]methyl]-3-(4-methoxy-2-nitro-phenyl)urea

Systemtic Name: 1-[[4-(4-chlorophenyl)-1,3-thiazol-2-yl]methyl]-3-(4-methoxy-2-nitro-phenyl)urea Openeye Name: 1-[[4-(4-chlorophenyl)thiazol-2-yl]methyl]-3-(4-methoxy-2-nitro-phenyl)urea CAS Name: 1-[[4-(4-chlorophenyl)-2-thiazolyl]methyl]-3-(4-methoxy-2-nitrophenyl)urea IUPAC Name: 1-[[4-(4-chlorophenyl)-1,3-thiazol-2-yl]methyl]-3-(4-methoxy-2-nitrophenyl)urea Traditional Name: 1-[[4-(4-chlorophenyl)thiazol-2-yl]methyl]-3-(4-methoxy-2-nitro-phenyl)urea Formula: C18H15ClN4O4S MolecularWeight: 418.8541

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)NC(=O)NCC2=NC(=CS2)C3=CC=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=C(C=C1)NC(=O)NCC2=NC(=CS2)C3=CC=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C18H15ClN4O4S/c1-27-13-6-7-14(16(8-13)23(25)26)22-18(24)20-9-17-21-15(10-28-17)11-2-4-12(19)5-3-11/h2-8,10H,9H2,1H3,(H2,20,22,24)