N-[4-(cyclopropylcarbamoylamino)phenyl]-4-methyl-2-(phenylmethyl)-1,3-thiazole-5-carboxamide

Systemtic Name: N-[4-(cyclopropylcarbamoylamino)phenyl]-4-methyl-2-(phenylmethyl)-1,3-thiazole-5-carboxamide Openeye Name: 2-benzyl-N-[4-(cyclopropylcarbamoylamino)phenyl]-4-methyl-thiazole-5-carboxamide CAS Name: N-[4-[[(cyclopropylamino)-oxomethyl]amino]phenyl]-4-methyl-2-(phenylmethyl)-5-thiazolecarboxamide IUPAC Name: 2-benzyl-N-[4-(cyclopropylcarbamoylamino)phenyl]-4-methyl-1,3-thiazole-5-carboxamide Traditional Name: 2-benzyl-N-[4-(cyclopropylcarbamoylamino)phenyl]-4-methyl-thiazole-5-carboxamide Formula: C22H22N4O2S MolecularWeight: 406.50068

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)CC2=CC=CC=C2)C(=O)NC3=CC=C(C=C3)NC(=O)NC4CC4

Isomeric SMILES

CC1=C(SC(=N1)CC2=CC=CC=C2)C(=O)NC3=CC=C(C=C3)NC(=O)NC4CC4

InChI

InChI=1S/C22H22N4O2S/c1-14-20(29-19(23-14)13-15-5-3-2-4-6-15)21(27)24-16-7-9-17(10-8-16)25-22(28)26-18-11-12-18/h2-10,18H,11-13H2,1H3,(H,24,27)(H2,25,26,28)