(2S)-2-azanyl-4-methyl-N-[4-(6-piperazin-1-ylpyridin-3-yl)thiophen-3-yl]pentanamide

Systemtic Name: (2S)-2-azanyl-4-methyl-N-[4-(6-piperazin-1-ylpyridin-3-yl)thiophen-3-yl]pentanamide Openeye Name: (2S)-2-amino-4-methyl-N-[4-(6-piperazin-1-yl-3-pyridyl)-3-thienyl]pentanamide CAS Name: (2S)-2-amino-4-methyl-N-[4-[6-(1-piperazinyl)-3-pyridinyl]-3-thiophenyl]pentanamide IUPAC Name: (2S)-2-amino-4-methyl-N-[4-(6-piperazin-1-ylpyridin-3-yl)thiophen-3-yl]pentanamide Traditional Name: (2S)-2-amino-4-methyl-N-[4-(6-piperazino-3-pyridyl)-3-thienyl]valeramide Formula: C19H27N5OS MolecularWeight: 373.51558

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC1=CSC=C1C2=CN=C(C=C2)N3CCNCC3)N

Isomeric SMILES

CC(C)C[C@@H](C(=O)NC1=CSC=C1C2=CN=C(C=C2)N3CCNCC3)N

InChI

InChI=1S/C19H27N5OS/c1-13(2)9-16(20)19(25)23-17-12-26-11-15(17)14-3-4-18(22-10-14)24-7-5-21-6-8-24/h3-4,10-13,16,21H,5-9,20H2,1-2H3,(H,23,25)/t16-/m0/s1