1-(4-nitrophenyl)-3-[[2-(pyrrolidin-1-ylmethyl)phenyl]methyl]thiourea

Systemtic Name: 1-(4-nitrophenyl)-3-[[2-(pyrrolidin-1-ylmethyl)phenyl]methyl]thiourea Openeye Name: 1-(4-nitrophenyl)-3-[[2-(pyrrolidin-1-ylmethyl)phenyl]methyl]thiourea CAS Name: 1-(4-nitrophenyl)-3-[[2-(1-pyrrolidinylmethyl)phenyl]methyl]thiourea IUPAC Name: 1-(4-nitrophenyl)-3-[[2-(pyrrolidin-1-ylmethyl)phenyl]methyl]thiourea Traditional Name: 1-(4-nitrophenyl)-3-[2-(pyrrolidinomethyl)benzyl]thiourea Formula: C19H22N4O2S MolecularWeight: 370.46858

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CC2=CC=CC=C2CNC(=S)NC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)CC2=CC=CC=C2CNC(=S)NC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H22N4O2S/c24-23(25)18-9-7-17(8-10-18)21-19(26)20-13-15-5-1-2-6-16(15)14-22-11-3-4-12-22/h1-2,5-10H,3-4,11-14H2,(H2,20,21,26)