1-[3-(4-methylpyrazol-1-yl)propyl]-3-(4-nitrophenyl)thiourea

Systemtic Name: 1-[3-(4-methylpyrazol-1-yl)propyl]-3-(4-nitrophenyl)thiourea Openeye Name: 1-[3-(4-methylpyrazol-1-yl)propyl]-3-(4-nitrophenyl)thiourea CAS Name: 1-[3-(4-methyl-1-pyrazolyl)propyl]-3-(4-nitrophenyl)thiourea IUPAC Name: 1-[3-(4-methylpyrazol-1-yl)propyl]-3-(4-nitrophenyl)thiourea Traditional Name: 1-[3-(4-methylpyrazol-1-yl)propyl]-3-(4-nitrophenyl)thiourea Formula: C14H17N5O2S MolecularWeight: 319.38208

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN(N=C1)CCCNC(=S)NC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=CN(N=C1)CCCNC(=S)NC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C14H17N5O2S/c1-11-9-16-18(10-11)8-2-7-15-14(22)17-12-3-5-13(6-4-12)19(20)21/h3-6,9-10H,2,7-8H2,1H3,(H2,15,17,22)