4-[1-azanyl-3-[[1-[(5-methylthiophen-2-yl)methyl]piperidin-4-yl]amino]-3-oxidanylidene-propyl]-N-pyridin-4-yl-benzamide

Systemtic Name: 4-[1-azanyl-3-[[1-[(5-methylthiophen-2-yl)methyl]piperidin-4-yl]amino]-3-oxidanylidene-propyl]-N-pyridin-4-yl-benzamide Openeye Name: 4-[1-amino-3-[[1-[(5-methyl-2-thienyl)methyl]-4-piperidyl]amino]-3-oxo-propyl]-N-(4-pyridyl)benzamide CAS Name: 4-[1-amino-3-[[1-[(5-methyl-2-thiophenyl)methyl]-4-piperidinyl]amino]-3-oxopropyl]-N-pyridin-4-ylbenzamide IUPAC Name: 4-[1-amino-3-[[1-[(5-methylthiophen-2-yl)methyl]piperidin-4-yl]amino]-3-oxopropyl]-N-pyridin-4-ylbenzamide Traditional Name: 4-[1-amino-3-keto-3-[[1-[(5-methyl-2-thienyl)methyl]-4-piperidyl]amino]propyl]-N-(4-pyridyl)benzamide Formula: C26H31N5O2S MolecularWeight: 477.62164

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)CN2CCC(CC2)NC(=O)CC(C3=CC=C(C=C3)C(=O)NC4=CC=NC=C4)N

Isomeric SMILES

CC1=CC=C(S1)CN2CCC(CC2)NC(=O)CC(C3=CC=C(C=C3)C(=O)NC4=CC=NC=C4)N

InChI

InChI=1S/C26H31N5O2S/c1-18-2-7-23(34-18)17-31-14-10-22(11-15-31)29-25(32)16-24(27)19-3-5-20(6-4-19)26(33)30-21-8-12-28-13-9-21/h2-9,12-13,22,24H,10-11,14-17,27H2,1H3,(H,29,32)(H,28,30,33)