[(2S)-1-[4-(2-methylbutan-2-yl)phenyl]sulfonylpyrrolidin-2-yl]-pyrido[3,4-b]indol-9-yl-methanone

Systemtic Name: [(2S)-1-[4-(2-methylbutan-2-yl)phenyl]sulfonylpyrrolidin-2-yl]-pyrido[3,4-b]indol-9-yl-methanone Openeye Name: [(2S)-1-[4-(1,1-dimethylpropyl)phenyl]sulfonylpyrrolidin-2-yl]-pyrido[3,4-b]indol-9-yl-methanone CAS Name: [(2S)-1-[4-(2-methylbutan-2-yl)phenyl]sulfonyl-2-pyrrolidinyl]-(9-pyrido[3,4-b]indolyl)methanone IUPAC Name: [(2S)-1-[4-(2-methylbutan-2-yl)phenyl]sulfonylpyrrolidin-2-yl]-pyrido[3,4-b]indol-9-ylmethanone Traditional Name: [(2S)-1-(4-tert-amylphenyl)sulfonylpyrrolidin-2-yl]-($b-carbolin-9-yl)methanone Formula: C27H29N3O3S MolecularWeight: 475.60246

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1=CC=C(C=C1)S(=O)(=O)N2CCCC2C(=O)N3C4=CC=CC=C4C5=C3C=NC=C5

Isomeric SMILES

CCC(C)(C)C1=CC=C(C=C1)S(=O)(=O)N2CCC[C@H]2C(=O)N3C4=CC=CC=C4C5=C3C=NC=C5

InChI

InChI=1S/C27H29N3O3S/c1-4-27(2,3)19-11-13-20(14-12-19)34(32,33)29-17-7-10-24(29)26(31)30-23-9-6-5-8-21(23)22-15-16-28-18-25(22)30/h5-6,8-9,11-16,18,24H,4,7,10,17H2,1-3H3/t24-/m0/s1