ethyl 5-azanyl-1-[4-[[1-(phenylmethyl)piperidin-4-yl]carbamoyl]phenyl]pyrazole-4-carboxylate

Systemtic Name: ethyl 5-azanyl-1-[4-[[1-(phenylmethyl)piperidin-4-yl]carbamoyl]phenyl]pyrazole-4-carboxylate Openeye Name: ethyl 5-amino-1-[4-[(1-benzyl-4-piperidyl)carbamoyl]phenyl]pyrazole-4-carboxylate CAS Name: 5-amino-1-[4-[oxo-[[1-(phenylmethyl)-4-piperidinyl]amino]methyl]phenyl]-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-amino-1-[4-[(1-benzylpiperidin-4-yl)carbamoyl]phenyl]pyrazole-4-carboxylate Traditional Name: 5-amino-1-[4-[(1-benzyl-4-piperidyl)carbamoyl]phenyl]pyrazole-4-carboxylic acid ethyl ester Formula: C25H29N5O3 MolecularWeight: 447.52946

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2=CC=C(C=C2)C(=O)NC3CCN(CC3)CC4=CC=CC=C4)N

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=CC=C(C=C2)C(=O)NC3CCN(CC3)CC4=CC=CC=C4)N

InChI

InChI=1S/C25H29N5O3/c1-2-33-25(32)22-16-27-30(23(22)26)21-10-8-19(9-11-21)24(31)28-20-12-14-29(15-13-20)17-18-6-4-3-5-7-18/h3-11,16,20H,2,12-15,17,26H2,1H3,(H,28,31)