N-[2-[[1-azanyl-3-(1H-indol-3-yl)-1-oxidanylidene-propan-2-yl]carbamoyl]-1-(1-methylpyrrol-2-yl)carbonyl-piperidin-4-yl]pyrazine-2-carboxamide

Systemtic Name: N-[2-[[1-azanyl-3-(1H-indol-3-yl)-1-oxidanylidene-propan-2-yl]carbamoyl]-1-(1-methylpyrrol-2-yl)carbonyl-piperidin-4-yl]pyrazine-2-carboxamide Openeye Name: N-[2-[[2-amino-1-(1H-indol-3-ylmethyl)-2-oxo-ethyl]carbamoyl]-1-(1-methylpyrrole-2-carbonyl)-4-piperidyl]pyrazine-2-carboxamide CAS Name: N-[2-[[[1-amino-3-(1H-indol-3-yl)-1-oxopropan-2-yl]amino]-oxomethyl]-1-[(1-methyl-2-pyrrolyl)-oxomethyl]-4-piperidinyl]-2-pyrazinecarboxamide IUPAC Name: N-[2-[[1-amino-3-(1H-indol-3-yl)-1-oxopropan-2-yl]carbamoyl]-1-(1-methylpyrrole-2-carbonyl)piperidin-4-yl]pyrazine-2-carboxamide Traditional Name: N-[2-[[2-amino-1-(1H-indol-3-ylmethyl)-2-keto-ethyl]carbamoyl]-1-(1-methylpyrrole-2-carbonyl)-4-piperidyl]pyrazinamide Formula: C28H30N8O4 MolecularWeight: 542.589

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1C(=O)N2CCC(CC2C(=O)NC(CC3=CNC4=CC=CC=C43)C(=O)N)NC(=O)C5=NC=CN=C5

Isomeric SMILES

CN1C=CC=C1C(=O)N2CCC(CC2C(=O)NC(CC3=CNC4=CC=CC=C43)C(=O)N)NC(=O)C5=NC=CN=C5

InChI

InChI=1S/C28H30N8O4/c1-35-11-4-7-23(35)28(40)36-12-8-18(33-26(38)22-16-30-9-10-31-22)14-24(36)27(39)34-21(25(29)37)13-17-15-32-20-6-3-2-5-19(17)20/h2-7,9-11,15-16,18,21,24,32H,8,12-14H2,1H3,(H2,29,37)(H,33,38)(H,34,39)