N-[(3S,4S)-3-methyl-1-phenethyl-piperidin-4-yl]-N-pyrazin-2-yl-thiophene-2-carboxamide

Systemtic Name: N-[(3S,4S)-3-methyl-1-phenethyl-piperidin-4-yl]-N-pyrazin-2-yl-thiophene-2-carboxamide Openeye Name: N-[(3S,4S)-3-methyl-1-phenethyl-4-piperidyl]-N-pyrazin-2-yl-thiophene-2-carboxamide CAS Name: N-[(3S,4S)-3-methyl-1-phenethyl-4-piperidinyl]-N-(2-pyrazinyl)-2-thiophenecarboxamide IUPAC Name: N-[(3S,4S)-3-methyl-1-phenethylpiperidin-4-yl]-N-pyrazin-2-ylthiophene-2-carboxamide Traditional Name: N-[(3S,4S)-3-methyl-1-phenethyl-4-piperidyl]-N-pyrazin-2-yl-thiophene-2-carboxamide Formula: C23H26N4OS MolecularWeight: 406.54374

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCC1N(C2=NC=CN=C2)C(=O)C3=CC=CS3)CCC4=CC=CC=C4

Isomeric SMILES

C[C@H]1CN(CC[C@@H]1N(C2=NC=CN=C2)C(=O)C3=CC=CS3)CCC4=CC=CC=C4

InChI

InChI=1S/C23H26N4OS/c1-18-17-26(13-9-19-6-3-2-4-7-19)14-10-20(18)27(22-16-24-11-12-25-22)23(28)21-8-5-15-29-21/h2-8,11-12,15-16,18,20H,9-10,13-14,17H2,1H3/t18-,20-/m0/s1