tert-butyl 4-[[4-[2-[(3-chloranylpyrazin-2-yl)amino]-3-ethoxy-3-oxidanylidene-propyl]phenyl]carbamoyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[[4-[2-[(3-chloranylpyrazin-2-yl)amino]-3-ethoxy-3-oxidanylidene-propyl]phenyl]carbamoyl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[[4-[2-[(3-chloropyrazin-2-yl)amino]-3-ethoxy-3-oxo-propyl]phenyl]carbamoyl]piperidine-1-carboxylate CAS Name: 4-[[4-[2-[(3-chloro-2-pyrazinyl)amino]-3-ethoxy-3-oxopropyl]anilino]-oxomethyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[[4-[2-[(3-chloropyrazin-2-yl)amino]-3-ethoxy-3-oxopropyl]phenyl]carbamoyl]piperidine-1-carboxylate Traditional Name: 4-[[4-[2-[(3-chloropyrazin-2-yl)amino]-3-ethoxy-3-keto-propyl]phenyl]carbamoyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C26H34ClN5O5 MolecularWeight: 532.03166

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=CC=C(C=C1)NC(=O)C2CCN(CC2)C(=O)OC(C)(C)C)NC3=NC=CN=C3Cl

Isomeric SMILES

CCOC(=O)C(CC1=CC=C(C=C1)NC(=O)C2CCN(CC2)C(=O)OC(C)(C)C)NC3=NC=CN=C3Cl

InChI

InChI=1S/C26H34ClN5O5/c1-5-36-24(34)20(31-22-21(27)28-12-13-29-22)16-17-6-8-19(9-7-17)30-23(33)18-10-14-32(15-11-18)25(35)37-26(2,3)4/h6-9,12-13,18,20H,5,10-11,14-16H2,1-4H3,(H,29,31)(H,30,33)