1-[1-[(2,4-dichlorophenyl)methyl]pyrazol-3-yl]-3-(3-nitrophenyl)thiourea

Systemtic Name: 1-[1-[(2,4-dichlorophenyl)methyl]pyrazol-3-yl]-3-(3-nitrophenyl)thiourea Openeye Name: 1-[1-[(2,4-dichlorophenyl)methyl]pyrazol-3-yl]-3-(3-nitrophenyl)thiourea CAS Name: 1-[1-[(2,4-dichlorophenyl)methyl]-3-pyrazolyl]-3-(3-nitrophenyl)thiourea IUPAC Name: 1-[1-[(2,4-dichlorophenyl)methyl]pyrazol-3-yl]-3-(3-nitrophenyl)thiourea Traditional Name: 1-[1-(2,4-dichlorobenzyl)pyrazol-3-yl]-3-(3-nitrophenyl)thiourea Formula: C17H13Cl2N5O2S MolecularWeight: 422.28842

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])NC(=S)NC2=NN(C=C2)CC3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])NC(=S)NC2=NN(C=C2)CC3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C17H13Cl2N5O2S/c18-12-5-4-11(15(19)8-12)10-23-7-6-16(22-23)21-17(27)20-13-2-1-3-14(9-13)24(25)26/h1-9H,10H2,(H2,20,21,22,27)