2-(1,3-benzoxazol-2-ylamino)-4-methyl-N-(2-thiophen-2-ylethyl)pyrimidine-5-carboxamide

Systemtic Name: 2-(1,3-benzoxazol-2-ylamino)-4-methyl-N-(2-thiophen-2-ylethyl)pyrimidine-5-carboxamide Openeye Name: 2-(1,3-benzoxazol-2-ylamino)-4-methyl-N-[2-(2-thienyl)ethyl]pyrimidine-5-carboxamide CAS Name: 2-(1,3-benzoxazol-2-ylamino)-4-methyl-N-(2-thiophen-2-ylethyl)-5-pyrimidinecarboxamide IUPAC Name: 2-(1,3-benzoxazol-2-ylamino)-4-methyl-N-(2-thiophen-2-ylethyl)pyrimidine-5-carboxamide Traditional Name: 2-(1,3-benzoxazol-2-ylamino)-4-methyl-N-[2-(2-thienyl)ethyl]pyrimidine-5-carboxamide Formula: C19H17N5O2S MolecularWeight: 379.43558

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC=C1C(=O)NCCC2=CC=CS2)NC3=NC4=CC=CC=C4O3

Isomeric SMILES

CC1=NC(=NC=C1C(=O)NCCC2=CC=CS2)NC3=NC4=CC=CC=C4O3

InChI

InChI=1S/C19H17N5O2S/c1-12-14(17(25)20-9-8-13-5-4-10-27-13)11-21-18(22-12)24-19-23-15-6-2-3-7-16(15)26-19/h2-7,10-11H,8-9H2,1H3,(H,20,25)(H,21,22,23,24)