2-[(4-butan-2-ylphenyl)-(3-nitrophenyl)sulfonyl-amino]-N-cyclopropyl-ethanamide

Systemtic Name: 2-[(4-butan-2-ylphenyl)-(3-nitrophenyl)sulfonyl-amino]-N-cyclopropyl-ethanamide Openeye Name: N-cyclopropyl-2-(N-(3-nitrophenyl)sulfonyl-4-sec-butyl-anilino)acetamide CAS Name: 2-(4-butan-2-yl-N-(3-nitrophenyl)sulfonylanilino)-N-cyclopropylacetamide IUPAC Name: 2-(4-butan-2-yl-N-(3-nitrophenyl)sulfonylanilino)-N-cyclopropylacetamide Traditional Name: N-cyclopropyl-2-(N-(3-nitrophenyl)sulfonyl-4-sec-butyl-anilino)acetamide Formula: C21H25N3O5S MolecularWeight: 431.5053

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)N(CC(=O)NC2CC2)S(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)N(CC(=O)NC2CC2)S(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H25N3O5S/c1-3-15(2)16-7-11-18(12-8-16)23(14-21(25)22-17-9-10-17)30(28,29)20-6-4-5-19(13-20)24(26)27/h4-8,11-13,15,17H,3,9-10,14H2,1-2H3,(H,22,25)