1-pteridin-4-yl-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)piperidine-4-carboxamide

Systemtic Name: 1-pteridin-4-yl-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)piperidine-4-carboxamide Openeye Name: 1-pteridin-4-yl-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)piperidine-4-carboxamide CAS Name: 1-(4-pteridinyl)-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)-4-piperidinecarboxamide IUPAC Name: 1-pteridin-4-yl-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)piperidine-4-carboxamide Traditional Name: 1-pteridin-4-yl-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)isonipecotamide Formula: C19H21N7OS MolecularWeight: 395.48134

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)N=C(S2)NC(=O)C3CCN(CC3)C4=NC=NC5=NC=CN=C54

Isomeric SMILES

C1CCC2=C(C1)N=C(S2)NC(=O)C3CCN(CC3)C4=NC=NC5=NC=CN=C54

InChI

InChI=1S/C19H21N7OS/c27-18(25-19-24-13-3-1-2-4-14(13)28-19)12-5-9-26(10-6-12)17-15-16(22-11-23-17)21-8-7-20-15/h7-8,11-12H,1-6,9-10H2,(H,24,25,27)