1-[1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-3-(4-nitrophenyl)urea

Systemtic Name: 1-[1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-3-(4-nitrophenyl)urea Openeye Name: 1-[1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-3-(4-nitrophenyl)urea CAS Name: 1-[1-(1H-benzimidazol-2-yl)-3-(methylthio)propyl]-3-(4-nitrophenyl)urea IUPAC Name: 1-[1-(1H-benzimidazol-2-yl)-3-methylsulfanylpropyl]-3-(4-nitrophenyl)urea Traditional Name: 1-[1-(1H-benzimidazol-2-yl)-3-(methylthio)propyl]-3-(4-nitrophenyl)urea Formula: C18H19N5O3S MolecularWeight: 385.44016

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C1=NC2=CC=CC=C2N1)NC(=O)NC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CSCCC(C1=NC2=CC=CC=C2N1)NC(=O)NC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H19N5O3S/c1-27-11-10-16(17-20-14-4-2-3-5-15(14)21-17)22-18(24)19-12-6-8-13(9-7-12)23(25)26/h2-9,16H,10-11H2,1H3,(H,20,21)(H2,19,22,24)