[3-methyl-5-(methylamino)-1,2-thiazol-4-yl]-[4-(pyridin-4-ylmethyl)piperazin-1-yl]methanone

Systemtic Name: [3-methyl-5-(methylamino)-1,2-thiazol-4-yl]-[4-(pyridin-4-ylmethyl)piperazin-1-yl]methanone Openeye Name: [3-methyl-5-(methylamino)isothiazol-4-yl]-[4-(4-pyridylmethyl)piperazin-1-yl]methanone CAS Name: [3-methyl-5-(methylamino)-4-isothiazolyl]-[4-(pyridin-4-ylmethyl)-1-piperazinyl]methanone IUPAC Name: [3-methyl-5-(methylamino)-1,2-thiazol-4-yl]-[4-(pyridin-4-ylmethyl)piperazin-1-yl]methanone Traditional Name: [3-methyl-5-(methylamino)isothiazol-4-yl]-[4-(4-pyridylmethyl)piperazino]methanone Formula: C16H21N5OS MolecularWeight: 331.43584

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NSC(=C1C(=O)N2CCN(CC2)CC3=CC=NC=C3)NC

Isomeric SMILES

CC1=NSC(=C1C(=O)N2CCN(CC2)CC3=CC=NC=C3)NC

InChI

InChI=1S/C16H21N5OS/c1-12-14(15(17-2)23-19-12)16(22)21-9-7-20(8-10-21)11-13-3-5-18-6-4-13/h3-6,17H,7-11H2,1-2H3