1-[2-(4-nitropyrazol-1-yl)ethyl]-3-[(1R)-1-phenylethyl]thiourea

Systemtic Name: 1-[2-(4-nitropyrazol-1-yl)ethyl]-3-[(1R)-1-phenylethyl]thiourea Openeye Name: 1-[2-(4-nitropyrazol-1-yl)ethyl]-3-[(1R)-1-phenylethyl]thiourea CAS Name: 1-[2-(4-nitro-1-pyrazolyl)ethyl]-3-[(1R)-1-phenylethyl]thiourea IUPAC Name: 1-[2-(4-nitropyrazol-1-yl)ethyl]-3-[(1R)-1-phenylethyl]thiourea Traditional Name: 1-[2-(4-nitropyrazol-1-yl)ethyl]-3-[(1R)-1-phenylethyl]thiourea Formula: C14H17N5O2S MolecularWeight: 319.38208

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC(=S)NCCN2C=C(C=N2)[N+](=O)[O-]

Isomeric SMILES

C[C@H](C1=CC=CC=C1)NC(=S)NCCN2C=C(C=N2)[N+](=O)[O-]

InChI

InChI=1S/C14H17N5O2S/c1-11(12-5-3-2-4-6-12)17-14(22)15-7-8-18-10-13(9-16-18)19(20)21/h2-6,9-11H,7-8H2,1H3,(H2,15,17,22)/t11-/m1/s1