N-[[(4R,5S)-5-azanyl-4-(2,4-dichlorophenyl)cyclohexen-1-yl]methyl]-3-chloranyl-4-methylsulfonyl-thiophene-2-carboxamide

Systemtic Name: N-[[(4R,5S)-5-azanyl-4-(2,4-dichlorophenyl)cyclohexen-1-yl]methyl]-3-chloranyl-4-methylsulfonyl-thiophene-2-carboxamide Openeye Name: N-[[(4R,5S)-5-amino-4-(2,4-dichlorophenyl)cyclohexen-1-yl]methyl]-3-chloro-4-methylsulfonyl-thiophene-2-carboxamide CAS Name: N-[[(4R,5S)-5-amino-4-(2,4-dichlorophenyl)-1-cyclohexenyl]methyl]-3-chloro-4-methylsulfonyl-2-thiophenecarboxamide IUPAC Name: N-[[(4R,5S)-5-amino-4-(2,4-dichlorophenyl)cyclohexen-1-yl]methyl]-3-chloro-4-methylsulfonylthiophene-2-carboxamide Traditional Name: N-[[(4R,5S)-5-amino-4-(2,4-dichlorophenyl)cyclohexen-1-yl]methyl]-3-chloro-4-mesyl-thiophene-2-carboxamide Formula: C19H19Cl3N2O3S2 MolecularWeight: 493.85476

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CSC(=C1Cl)C(=O)NCC2=CCC(C(C2)N)C3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

CS(=O)(=O)C1=CSC(=C1Cl)C(=O)NCC2=CC[C@@H]([C@H](C2)N)C3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C19H19Cl3N2O3S2/c1-29(26,27)16-9-28-18(17(16)22)19(25)24-8-10-2-4-13(15(23)6-10)12-5-3-11(20)7-14(12)21/h2-3,5,7,9,13,15H,4,6,8,23H2,1H3,(H,24,25)/t13-,15+/m1/s1