4-[(2,5-dimethylphenyl)-methylsulfonyl-amino]-N-(9-ethylcarbazol-3-yl)butanamide

Systemtic Name: 4-[(2,5-dimethylphenyl)-methylsulfonyl-amino]-N-(9-ethylcarbazol-3-yl)butanamide Openeye Name: 4-(2,5-dimethyl-N-methylsulfonyl-anilino)-N-(9-ethylcarbazol-3-yl)butanamide CAS Name: 4-(2,5-dimethyl-N-methylsulfonylanilino)-N-(9-ethyl-3-carbazolyl)butanamide IUPAC Name: 4-(2,5-dimethyl-N-methylsulfonylanilino)-N-(9-ethylcarbazol-3-yl)butanamide Traditional Name: N-(9-ethylcarbazol-3-yl)-4-(N-mesyl-2,5-dimethyl-anilino)butyramide Formula: C27H31N3O3S MolecularWeight: 477.61834

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)NC(=O)CCCN(C3=C(C=CC(=C3)C)C)S(=O)(=O)C)C4=CC=CC=C41

Isomeric SMILES

CCN1C2=C(C=C(C=C2)NC(=O)CCCN(C3=C(C=CC(=C3)C)C)S(=O)(=O)C)C4=CC=CC=C41

InChI

InChI=1S/C27H31N3O3S/c1-5-29-24-10-7-6-9-22(24)23-18-21(14-15-25(23)29)28-27(31)11-8-16-30(34(4,32)33)26-17-19(2)12-13-20(26)3/h6-7,9-10,12-15,17-18H,5,8,11,16H2,1-4H3,(H,28,31)