N-(4-methyl-5-phenyl-3-piperidin-1-ylcarbonyl-thiophen-2-yl)-2-[(5-methyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]ethanamide

Systemtic Name: N-(4-methyl-5-phenyl-3-piperidin-1-ylcarbonyl-thiophen-2-yl)-2-[(5-methyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: 2-[(4-allyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-[4-methyl-5-phenyl-3-(piperidine-1-carbonyl)-2-thienyl]acetamide CAS Name: N-[4-methyl-3-[oxo(1-piperidinyl)methyl]-5-phenyl-2-thiophenyl]-2-[(5-methyl-4-prop-2-enyl-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: N-[4-methyl-5-phenyl-3-(piperidine-1-carbonyl)thiophen-2-yl]-2-[(5-methyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: 2-[(4-allyl-5-methyl-1,2,4-triazol-3-yl)thio]-N-[4-methyl-5-phenyl-3-(piperidine-1-carbonyl)-2-thienyl]acetamide Formula: C25H29N5O2S2 MolecularWeight: 495.66006

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)N2CCCCC2)NC(=O)CSC3=NN=C(N3CC=C)C)C4=CC=CC=C4

Isomeric SMILES

CC1=C(SC(=C1C(=O)N2CCCCC2)NC(=O)CSC3=NN=C(N3CC=C)C)C4=CC=CC=C4

InChI

InChI=1S/C25H29N5O2S2/c1-4-13-30-18(3)27-28-25(30)33-16-20(31)26-23-21(24(32)29-14-9-6-10-15-29)17(2)22(34-23)19-11-7-5-8-12-19/h4-5,7-8,11-12H,1,6,9-10,13-16H2,2-3H3,(H,26,31)