2-methyl-1-(3-phenylpropyl)-5-(2-pyrazin-2-yl-1,3-thiazol-4-yl)pyrrole-3-carboxamide

Systemtic Name: 2-methyl-1-(3-phenylpropyl)-5-(2-pyrazin-2-yl-1,3-thiazol-4-yl)pyrrole-3-carboxamide Openeye Name: 2-methyl-1-(3-phenylpropyl)-5-(2-pyrazin-2-ylthiazol-4-yl)pyrrole-3-carboxamide CAS Name: 2-methyl-1-(3-phenylpropyl)-5-[2-(2-pyrazinyl)-4-thiazolyl]-3-pyrrolecarboxamide IUPAC Name: 2-methyl-1-(3-phenylpropyl)-5-(2-pyrazin-2-yl-1,3-thiazol-4-yl)pyrrole-3-carboxamide Traditional Name: 2-methyl-1-(3-phenylpropyl)-5-(2-pyrazin-2-ylthiazol-4-yl)pyrrole-3-carboxamide Formula: C22H21N5OS MolecularWeight: 403.50004

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(N1CCCC2=CC=CC=C2)C3=CSC(=N3)C4=NC=CN=C4)C(=O)N

Isomeric SMILES

CC1=C(C=C(N1CCCC2=CC=CC=C2)C3=CSC(=N3)C4=NC=CN=C4)C(=O)N

InChI

InChI=1S/C22H21N5OS/c1-15-17(21(23)28)12-20(27(15)11-5-8-16-6-3-2-4-7-16)19-14-29-22(26-19)18-13-24-9-10-25-18/h2-4,6-7,9-10,12-14H,5,8,11H2,1H3,(H2,23,28)