N-[4-(2,5-dimethyl-1-phenethyl-pyrrol-3-yl)-1,3-thiazol-2-yl]pyrazine-2-carboxamide

Systemtic Name: N-[4-(2,5-dimethyl-1-phenethyl-pyrrol-3-yl)-1,3-thiazol-2-yl]pyrazine-2-carboxamide Openeye Name: N-[4-(2,5-dimethyl-1-phenethyl-pyrrol-3-yl)thiazol-2-yl]pyrazine-2-carboxamide CAS Name: N-[4-(2,5-dimethyl-1-phenethyl-3-pyrrolyl)-2-thiazolyl]-2-pyrazinecarboxamide IUPAC Name: N-[4-(2,5-dimethyl-1-phenethylpyrrol-3-yl)-1,3-thiazol-2-yl]pyrazine-2-carboxamide Traditional Name: N-[4-(2,5-dimethyl-1-phenethyl-pyrrol-3-yl)thiazol-2-yl]pyrazinamide Formula: C22H21N5OS MolecularWeight: 403.50004

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CCC2=CC=CC=C2)C)C3=CSC(=N3)NC(=O)C4=NC=CN=C4

Isomeric SMILES

CC1=CC(=C(N1CCC2=CC=CC=C2)C)C3=CSC(=N3)NC(=O)C4=NC=CN=C4

InChI

InChI=1S/C22H21N5OS/c1-15-12-18(16(2)27(15)11-8-17-6-4-3-5-7-17)20-14-29-22(25-20)26-21(28)19-13-23-9-10-24-19/h3-7,9-10,12-14H,8,11H2,1-2H3,(H,25,26,28)