1-(3-nitrophenyl)-3-pentyl-thiourea

Systemtic Name: 1-(3-nitrophenyl)-3-pentyl-thiourea Openeye Name: 1-(3-nitrophenyl)-3-pentyl-thiourea CAS Name: 1-(3-nitrophenyl)-3-pentylthiourea IUPAC Name: 1-(3-nitrophenyl)-3-pentylthiourea Traditional Name: 1-amyl-3-(3-nitrophenyl)thiourea Formula: C12H17N3O2S MolecularWeight: 267.34728

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=S)NC1=CC(=CC=C1)[N+](=O)[O-]

Isomeric SMILES

CCCCCNC(=S)NC1=CC(=CC=C1)[N+](=O)[O-]

InChI

InChI=1S/C12H17N3O2S/c1-2-3-4-8-13-12(18)14-10-6-5-7-11(9-10)15(16)17/h5-7,9H,2-4,8H2,1H3,(H2,13,14,18)