N-[4-[(2-methyl-3-nitro-phenyl)amino]-4-oxidanylidene-butyl]thiophene-3-carboxamide

Systemtic Name: N-[4-[(2-methyl-3-nitro-phenyl)amino]-4-oxidanylidene-butyl]thiophene-3-carboxamide Openeye Name: N-[4-(2-methyl-3-nitro-anilino)-4-oxo-butyl]thiophene-3-carboxamide CAS Name: N-[4-(2-methyl-3-nitroanilino)-4-oxobutyl]-3-thiophenecarboxamide IUPAC Name: N-[4-(2-methyl-3-nitroanilino)-4-oxobutyl]thiophene-3-carboxamide Traditional Name: N-[4-keto-4-(2-methyl-3-nitro-anilino)butyl]thiophene-3-carboxamide Formula: C16H17N3O4S MolecularWeight: 347.38888

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1[N+](=O)[O-])NC(=O)CCCNC(=O)C2=CSC=C2

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)[O-])NC(=O)CCCNC(=O)C2=CSC=C2

InChI

InChI=1S/C16H17N3O4S/c1-11-13(4-2-5-14(11)19(22)23)18-15(20)6-3-8-17-16(21)12-7-9-24-10-12/h2,4-5,7,9-10H,3,6,8H2,1H3,(H,17,21)(H,18,20)