N-[6-cyano-1-[(3-methylimidazol-4-yl)methyl]-3,4-dihydro-2H-quinolin-3-yl]-4-methyl-N-[(4-methylsulfonylphenyl)methyl]thiophene-3-sulfonamide

Systemtic Name: N-[6-cyano-1-[(3-methylimidazol-4-yl)methyl]-3,4-dihydro-2H-quinolin-3-yl]-4-methyl-N-[(4-methylsulfonylphenyl)methyl]thiophene-3-sulfonamide Openeye Name: N-[6-cyano-1-[(3-methylimidazol-4-yl)methyl]-3,4-dihydro-2H-quinolin-3-yl]-4-methyl-N-[(4-methylsulfonylphenyl)methyl]thiophene-3-sulfonamide CAS Name: N-[6-cyano-1-[(3-methyl-4-imidazolyl)methyl]-3,4-dihydro-2H-quinolin-3-yl]-4-methyl-N-[(4-methylsulfonylphenyl)methyl]-3-thiophenesulfonamide IUPAC Name: N-[6-cyano-1-[(3-methylimidazol-4-yl)methyl]-3,4-dihydro-2H-quinolin-3-yl]-4-methyl-N-[(4-methylsulfonylphenyl)methyl]thiophene-3-sulfonamide Traditional Name: N-[6-cyano-1-[(3-methylimidazol-4-yl)methyl]-3,4-dihydro-2H-quinolin-3-yl]-N-(4-mesylbenzyl)-4-methyl-thiophene-3-sulfonamide Formula: C28H29N5O4S3 MolecularWeight: 595.75596

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC=C1S(=O)(=O)N(CC2=CC=C(C=C2)S(=O)(=O)C)C3CC4=C(C=CC(=C4)C#N)N(C3)CC5=CN=CN5C

Isomeric SMILES

CC1=CSC=C1S(=O)(=O)N(CC2=CC=C(C=C2)S(=O)(=O)C)C3CC4=C(C=CC(=C4)C#N)N(C3)CC5=CN=CN5C

InChI

InChI=1S/C28H29N5O4S3/c1-20-17-38-18-28(20)40(36,37)33(14-21-4-7-26(8-5-21)39(3,34)35)24-11-23-10-22(12-29)6-9-27(23)32(15-24)16-25-13-30-19-31(25)2/h4-10,13,17-19,24H,11,14-16H2,1-3H3