N-[4-(cyclopropylcarbamoyl)phenyl]-4-methylsulfanyl-3-nitro-benzamide

Systemtic Name: N-[4-(cyclopropylcarbamoyl)phenyl]-4-methylsulfanyl-3-nitro-benzamide Openeye Name: N-[4-(cyclopropylcarbamoyl)phenyl]-4-methylsulfanyl-3-nitro-benzamide CAS Name: N-[4-[(cyclopropylamino)-oxomethyl]phenyl]-4-(methylthio)-3-nitrobenzamide IUPAC Name: N-[4-(cyclopropylcarbamoyl)phenyl]-4-methylsulfanyl-3-nitrobenzamide Traditional Name: N-[4-(cyclopropylcarbamoyl)phenyl]-4-(methylthio)-3-nitro-benzamide Formula: C18H17N3O4S MolecularWeight: 371.41028

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C=C(C=C1)C(=O)NC2=CC=C(C=C2)C(=O)NC3CC3)[N+](=O)[O-]

Isomeric SMILES

CSC1=C(C=C(C=C1)C(=O)NC2=CC=C(C=C2)C(=O)NC3CC3)[N+](=O)[O-]

InChI

InChI=1S/C18H17N3O4S/c1-26-16-9-4-12(10-15(16)21(24)25)18(23)20-13-5-2-11(3-6-13)17(22)19-14-7-8-14/h2-6,9-10,14H,7-8H2,1H3,(H,19,22)(H,20,23)