N-[(3S)-1-[4-[[5-(4-methylpiperazin-1-yl)pyridin-2-yl]amino]-1,5-naphthyridin-2-yl]piperidin-3-yl]-1-benzothiophene-2-carboxamide

Systemtic Name: N-[(3S)-1-[4-[[5-(4-methylpiperazin-1-yl)pyridin-2-yl]amino]-1,5-naphthyridin-2-yl]piperidin-3-yl]-1-benzothiophene-2-carboxamide Openeye Name: N-[(3S)-1-[4-[[5-(4-methylpiperazin-1-yl)-2-pyridyl]amino]-1,5-naphthyridin-2-yl]-3-piperidyl]benzothiophene-2-carboxamide CAS Name: N-[(3S)-1-[4-[[5-(4-methyl-1-piperazinyl)-2-pyridinyl]amino]-1,5-naphthyridin-2-yl]-3-piperidinyl]-1-benzothiophene-2-carboxamide IUPAC Name: N-[(3S)-1-[4-[[5-(4-methylpiperazin-1-yl)pyridin-2-yl]amino]-1,5-naphthyridin-2-yl]piperidin-3-yl]-1-benzothiophene-2-carboxamide Traditional Name: N-[(3S)-1-[4-[[5-(4-methylpiperazino)-2-pyridyl]amino]-1,5-naphthyridin-2-yl]-3-piperidyl]benzothiophene-2-carboxamide Formula: C32H34N8OS MolecularWeight: 578.73036

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=CN=C(C=C2)NC3=CC(=NC4=C3N=CC=C4)N5CCCC(C5)NC(=O)C6=CC7=CC=CC=C7S6

Isomeric SMILES

CN1CCN(CC1)C2=CN=C(C=C2)NC3=CC(=NC4=C3N=CC=C4)N5CCC[C@@H](C5)NC(=O)C6=CC7=CC=CC=C7S6

InChI

InChI=1S/C32H34N8OS/c1-38-14-16-39(17-15-38)24-10-11-29(34-20-24)36-26-19-30(37-25-8-4-12-33-31(25)26)40-13-5-7-23(21-40)35-32(41)28-18-22-6-2-3-9-27(22)42-28/h2-4,6,8-12,18-20,23H,5,7,13-17,21H2,1H3,(H,35,41)(H,34,36,37)/t23-/m0/s1