2-(1,2-benzoxazol-3-yl)-N-[4-(2,5-dimethyl-1-propyl-pyrrol-3-yl)-1,3-thiazol-2-yl]ethanamide

Systemtic Name: 2-(1,2-benzoxazol-3-yl)-N-[4-(2,5-dimethyl-1-propyl-pyrrol-3-yl)-1,3-thiazol-2-yl]ethanamide Openeye Name: 2-(1,2-benzoxazol-3-yl)-N-[4-(2,5-dimethyl-1-propyl-pyrrol-3-yl)thiazol-2-yl]acetamide CAS Name: 2-(1,2-benzoxazol-3-yl)-N-[4-(2,5-dimethyl-1-propyl-3-pyrrolyl)-2-thiazolyl]acetamide IUPAC Name: 2-(1,2-benzoxazol-3-yl)-N-[4-(2,5-dimethyl-1-propylpyrrol-3-yl)-1,3-thiazol-2-yl]acetamide Traditional Name: N-[4-(2,5-dimethyl-1-propyl-pyrrol-3-yl)thiazol-2-yl]-2-indoxazen-3-yl-acetamide Formula: C21H22N4O2S MolecularWeight: 394.48998

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=CC(=C1C)C2=CSC(=N2)NC(=O)CC3=NOC4=CC=CC=C43)C

Isomeric SMILES

CCCN1C(=CC(=C1C)C2=CSC(=N2)NC(=O)CC3=NOC4=CC=CC=C43)C

InChI

InChI=1S/C21H22N4O2S/c1-4-9-25-13(2)10-16(14(25)3)18-12-28-21(22-18)23-20(26)11-17-15-7-5-6-8-19(15)27-24-17/h5-8,10,12H,4,9,11H2,1-3H3,(H,22,23,26)