N-[5-(cyclopropylcarbamoyl)-2-methyl-phenyl]-4-methyl-2-(pyridin-3-ylmethylamino)-1,3-thiazole-5-carboxamide

Systemtic Name: N-[5-(cyclopropylcarbamoyl)-2-methyl-phenyl]-4-methyl-2-(pyridin-3-ylmethylamino)-1,3-thiazole-5-carboxamide Openeye Name: N-[5-(cyclopropylcarbamoyl)-2-methyl-phenyl]-4-methyl-2-(3-pyridylmethylamino)thiazole-5-carboxamide CAS Name: N-[5-[(cyclopropylamino)-oxomethyl]-2-methylphenyl]-4-methyl-2-(3-pyridinylmethylamino)-5-thiazolecarboxamide IUPAC Name: N-[5-(cyclopropylcarbamoyl)-2-methylphenyl]-4-methyl-2-(pyridin-3-ylmethylamino)-1,3-thiazole-5-carboxamide Traditional Name: N-[5-(cyclopropylcarbamoyl)-2-methyl-phenyl]-4-methyl-2-(3-pyridylmethylamino)thiazole-5-carboxamide Formula: C22H23N5O2S MolecularWeight: 421.51532

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2CC2)NC(=O)C3=C(N=C(S3)NCC4=CN=CC=C4)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2CC2)NC(=O)C3=C(N=C(S3)NCC4=CN=CC=C4)C

InChI

InChI=1S/C22H23N5O2S/c1-13-5-6-16(20(28)26-17-7-8-17)10-18(13)27-21(29)19-14(2)25-22(30-19)24-12-15-4-3-9-23-11-15/h3-6,9-11,17H,7-8,12H2,1-2H3,(H,24,25)(H,26,28)(H,27,29)