N-[4-(2,5-dimethyl-1-prop-2-enyl-pyrrol-3-yl)-1,3-thiazol-2-yl]-2-(3-oxidanylidene-1,4-benzoxazin-4-yl)ethanamide

Systemtic Name: N-[4-(2,5-dimethyl-1-prop-2-enyl-pyrrol-3-yl)-1,3-thiazol-2-yl]-2-(3-oxidanylidene-1,4-benzoxazin-4-yl)ethanamide Openeye Name: N-[4-(1-allyl-2,5-dimethyl-pyrrol-3-yl)thiazol-2-yl]-2-(3-oxo-1,4-benzoxazin-4-yl)acetamide CAS Name: N-[4-(2,5-dimethyl-1-prop-2-enyl-3-pyrrolyl)-2-thiazolyl]-2-(3-oxo-1,4-benzoxazin-4-yl)acetamide IUPAC Name: N-[4-(2,5-dimethyl-1-prop-2-enylpyrrol-3-yl)-1,3-thiazol-2-yl]-2-(3-oxo-1,4-benzoxazin-4-yl)acetamide Traditional Name: N-[4-(1-allyl-2,5-dimethyl-pyrrol-3-yl)thiazol-2-yl]-2-(3-keto-1,4-benzoxazin-4-yl)acetamide Formula: C22H22N4O3S MolecularWeight: 422.50008

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CC=C)C)C2=CSC(=N2)NC(=O)CN3C(=O)COC4=CC=CC=C43

Isomeric SMILES

CC1=CC(=C(N1CC=C)C)C2=CSC(=N2)NC(=O)CN3C(=O)COC4=CC=CC=C43

InChI

InChI=1S/C22H22N4O3S/c1-4-9-25-14(2)10-16(15(25)3)17-13-30-22(23-17)24-20(27)11-26-18-7-5-6-8-19(18)29-12-21(26)28/h4-8,10,13H,1,9,11-12H2,2-3H3,(H,23,24,27)