6-chloranyl-3-methyl-N-[(3S)-2-oxidanylidene-1-[2-(pyridin-4-ylamino)ethyl]pyrrolidin-3-yl]-1-benzothiophene-2-sulfonamide

Systemtic Name: 6-chloranyl-3-methyl-N-[(3S)-2-oxidanylidene-1-[2-(pyridin-4-ylamino)ethyl]pyrrolidin-3-yl]-1-benzothiophene-2-sulfonamide Openeye Name: 6-chloro-3-methyl-N-[(3S)-2-oxo-1-[2-(4-pyridylamino)ethyl]pyrrolidin-3-yl]benzothiophene-2-sulfonamide CAS Name: 6-chloro-3-methyl-N-[(3S)-2-oxo-1-[2-(pyridin-4-ylamino)ethyl]-3-pyrrolidinyl]-1-benzothiophene-2-sulfonamide IUPAC Name: 6-chloro-3-methyl-N-[(3S)-2-oxo-1-[2-(pyridin-4-ylamino)ethyl]pyrrolidin-3-yl]-1-benzothiophene-2-sulfonamide Traditional Name: 6-chloro-N-[(3S)-2-keto-1-[2-(4-pyridylamino)ethyl]pyrrolidin-3-yl]-3-methyl-benzothiophene-2-sulfonamide Formula: C20H21ClN4O3S2 MolecularWeight: 464.98874

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C=CC(=C2)Cl)S(=O)(=O)NC3CCN(C3=O)CCNC4=CC=NC=C4

Isomeric SMILES

CC1=C(SC2=C1C=CC(=C2)Cl)S(=O)(=O)N[C@H]3CCN(C3=O)CCNC4=CC=NC=C4

InChI

InChI=1S/C20H21ClN4O3S2/c1-13-16-3-2-14(21)12-18(16)29-20(13)30(27,28)24-17-6-10-25(19(17)26)11-9-23-15-4-7-22-8-5-15/h2-5,7-8,12,17,24H,6,9-11H2,1H3,(H,22,23)/t17-/m0/s1