5-methyl-N-[1-(phenylmethyl)pyrrolidin-3-yl]-1-(5H-thiochromeno[4,3-d]pyrimidin-2-yl)pyrazole-4-carboxamide

Systemtic Name: 5-methyl-N-[1-(phenylmethyl)pyrrolidin-3-yl]-1-(5H-thiochromeno[4,3-d]pyrimidin-2-yl)pyrazole-4-carboxamide Openeye Name: N-(1-benzylpyrrolidin-3-yl)-5-methyl-1-(5H-thiochromeno[4,3-d]pyrimidin-2-yl)pyrazole-4-carboxamide CAS Name: 5-methyl-N-[1-(phenylmethyl)-3-pyrrolidinyl]-1-(5H-thiochromeno[4,3-d]pyrimidin-2-yl)-4-pyrazolecarboxamide IUPAC Name: N-(1-benzylpyrrolidin-3-yl)-5-methyl-1-(5H-thiochromeno[4,3-d]pyrimidin-2-yl)pyrazole-4-carboxamide Traditional Name: N-(1-benzylpyrrolidin-3-yl)-5-methyl-1-(5H-thiochromeno[4,3-d]pyrimidin-2-yl)pyrazole-4-carboxamide Formula: C27H26N6OS MolecularWeight: 482.59994

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C2=NC=C3CSC4=CC=CC=C4C3=N2)C(=O)NC5CCN(C5)CC6=CC=CC=C6

Isomeric SMILES

CC1=C(C=NN1C2=NC=C3CSC4=CC=CC=C4C3=N2)C(=O)NC5CCN(C5)CC6=CC=CC=C6

InChI

InChI=1S/C27H26N6OS/c1-18-23(26(34)30-21-11-12-32(16-21)15-19-7-3-2-4-8-19)14-29-33(18)27-28-13-20-17-35-24-10-6-5-9-22(24)25(20)31-27/h2-10,13-14,21H,11-12,15-17H2,1H3,(H,30,34)