(2S)-3-azanyl-5-(2,6-dimethylphenyl)imino-N-(2-methylsulfanylphenyl)-4-piperidin-1-ylcarbonyl-2H-thiophene-2-carboxamide

Systemtic Name: (2S)-3-azanyl-5-(2,6-dimethylphenyl)imino-N-(2-methylsulfanylphenyl)-4-piperidin-1-ylcarbonyl-2H-thiophene-2-carboxamide Openeye Name: (2S)-3-amino-5-(2,6-dimethylphenyl)imino-N-(2-methylsulfanylphenyl)-4-(piperidine-1-carbonyl)-2H-thiophene-2-carboxamide CAS Name: (2S)-3-amino-5-(2,6-dimethylphenyl)imino-N-[2-(methylthio)phenyl]-4-[oxo(1-piperidinyl)methyl]-2H-thiophene-2-carboxamide IUPAC Name: (2S)-3-amino-5-(2,6-dimethylphenyl)imino-N-(2-methylsulfanylphenyl)-4-(piperidine-1-carbonyl)-2H-thiophene-2-carboxamide Traditional Name: (2S)-3-amino-5-(2,6-dimethylphenyl)imino-N-[2-(methylthio)phenyl]-4-(piperidine-1-carbonyl)-2H-thiophene-2-carboxamide Formula: C26H30N4O2S2 MolecularWeight: 494.672

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)N=C2C(=C(C(S2)C(=O)NC3=CC=CC=C3SC)N)C(=O)N4CCCCC4

Isomeric SMILES

CC1=C(C(=CC=C1)C)N=C2C(=C([C@H](S2)C(=O)NC3=CC=CC=C3SC)N)C(=O)N4CCCCC4

InChI

InChI=1S/C26H30N4O2S2/c1-16-10-9-11-17(2)22(16)29-25-20(26(32)30-14-7-4-8-15-30)21(27)23(34-25)24(31)28-18-12-5-6-13-19(18)33-3/h5-6,9-13,23H,4,7-8,14-15,27H2,1-3H3,(H,28,31)/t23-/m0/s1