N-[6-[4-(2-azanyl-2-oxidanylidene-ethyl)piperazin-1-yl]pyridin-3-yl]-3-methoxy-2-(4-propan-2-ylphenyl)benzamide

Systemtic Name: N-[6-[4-(2-azanyl-2-oxidanylidene-ethyl)piperazin-1-yl]pyridin-3-yl]-3-methoxy-2-(4-propan-2-ylphenyl)benzamide Openeye Name: N-[6-[4-(2-amino-2-oxo-ethyl)piperazin-1-yl]-3-pyridyl]-2-(4-isopropylphenyl)-3-methoxy-benzamide CAS Name: N-[6-[4-(2-amino-2-oxoethyl)-1-piperazinyl]-3-pyridinyl]-3-methoxy-2-(4-propan-2-ylphenyl)benzamide IUPAC Name: N-[6-[4-(2-amino-2-oxoethyl)piperazin-1-yl]pyridin-3-yl]-3-methoxy-2-(4-propan-2-ylphenyl)benzamide Traditional Name: N-[6-[4-(2-amino-2-keto-ethyl)piperazino]-3-pyridyl]-3-methoxy-2-p-cumenyl-benzamide Formula: C28H33N5O3 MolecularWeight: 487.59332

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C2=C(C=CC=C2OC)C(=O)NC3=CN=C(C=C3)N4CCN(CC4)CC(=O)N

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C2=C(C=CC=C2OC)C(=O)NC3=CN=C(C=C3)N4CCN(CC4)CC(=O)N

InChI

InChI=1S/C28H33N5O3/c1-19(2)20-7-9-21(10-8-20)27-23(5-4-6-24(27)36-3)28(35)31-22-11-12-26(30-17-22)33-15-13-32(14-16-33)18-25(29)34/h4-12,17,19H,13-16,18H2,1-3H3,(H2,29,34)(H,31,35)