N-[4-[2-[(4-butylphenyl)amino]-2-oxidanylidene-ethyl]-1,3-thiazol-2-yl]-4-pyridin-2-yl-piperazine-1-carboxamide

Systemtic Name: N-[4-[2-[(4-butylphenyl)amino]-2-oxidanylidene-ethyl]-1,3-thiazol-2-yl]-4-pyridin-2-yl-piperazine-1-carboxamide Openeye Name: N-[4-[2-(4-butylanilino)-2-oxo-ethyl]thiazol-2-yl]-4-(2-pyridyl)piperazine-1-carboxamide CAS Name: N-[4-[2-(4-butylanilino)-2-oxoethyl]-2-thiazolyl]-4-(2-pyridinyl)-1-piperazinecarboxamide IUPAC Name: N-[4-[2-(4-butylanilino)-2-oxoethyl]-1,3-thiazol-2-yl]-4-pyridin-2-ylpiperazine-1-carboxamide Traditional Name: N-[4-[2-(4-butylanilino)-2-keto-ethyl]thiazol-2-yl]-4-(2-pyridyl)piperazine-1-carboxamide Formula: C25H30N6O2S MolecularWeight: 478.6097

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=O)CC2=CSC(=N2)NC(=O)N3CCN(CC3)C4=CC=CC=N4

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=O)CC2=CSC(=N2)NC(=O)N3CCN(CC3)C4=CC=CC=N4

InChI

InChI=1S/C25H30N6O2S/c1-2-3-6-19-8-10-20(11-9-19)27-23(32)17-21-18-34-24(28-21)29-25(33)31-15-13-30(14-16-31)22-7-4-5-12-26-22/h4-5,7-12,18H,2-3,6,13-17H2,1H3,(H,27,32)(H,28,29,33)