3-azanyl-N-[4-[(3S)-3-azanylpiperidin-1-yl]pyridin-3-yl]-6-(2-methyl-5-pyrrolidin-1-ylsulfonyl-phenyl)pyridine-2-carboxamide

Systemtic Name: 3-azanyl-N-[4-[(3S)-3-azanylpiperidin-1-yl]pyridin-3-yl]-6-(2-methyl-5-pyrrolidin-1-ylsulfonyl-phenyl)pyridine-2-carboxamide Openeye Name: 3-amino-N-[4-[(3S)-3-amino-1-piperidyl]-3-pyridyl]-6-(2-methyl-5-pyrrolidin-1-ylsulfonyl-phenyl)pyridine-2-carboxamide CAS Name: 3-amino-N-[4-[(3S)-3-amino-1-piperidinyl]-3-pyridinyl]-6-[2-methyl-5-(1-pyrrolidinylsulfonyl)phenyl]-2-pyridinecarboxamide IUPAC Name: 3-amino-N-[4-[(3S)-3-aminopiperidin-1-yl]pyridin-3-yl]-6-(2-methyl-5-pyrrolidin-1-ylsulfonylphenyl)pyridine-2-carboxamide Traditional Name: 3-amino-N-[4-[(3S)-3-aminopiperidino]-3-pyridyl]-6-(2-methyl-5-pyrrolidinosulfonyl-phenyl)picolinamide Formula: C27H33N7O3S MolecularWeight: 535.66102

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCC2)C3=NC(=C(C=C3)N)C(=O)NC4=C(C=CN=C4)N5CCCC(C5)N

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCC2)C3=NC(=C(C=C3)N)C(=O)NC4=C(C=CN=C4)N5CCC[C@@H](C5)N

InChI

InChI=1S/C27H33N7O3S/c1-18-6-7-20(38(36,37)34-13-2-3-14-34)15-21(18)23-9-8-22(29)26(31-23)27(35)32-24-16-30-11-10-25(24)33-12-4-5-19(28)17-33/h6-11,15-16,19H,2-5,12-14,17,28-29H2,1H3,(H,32,35)/t19-/m0/s1