3-chloranyl-N-(3-oxidanylidene-4-prop-2-enyl-1,4-benzoxazin-6-yl)-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-N-(3-oxidanylidene-4-prop-2-enyl-1,4-benzoxazin-6-yl)-1-benzothiophene-2-carboxamide Openeye Name: N-(4-allyl-3-oxo-1,4-benzoxazin-6-yl)-3-chloro-benzothiophene-2-carboxamide CAS Name: 3-chloro-N-(3-oxo-4-prop-2-enyl-1,4-benzoxazin-6-yl)-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-N-(3-oxo-4-prop-2-enyl-1,4-benzoxazin-6-yl)-1-benzothiophene-2-carboxamide Traditional Name: N-(4-allyl-3-keto-1,4-benzoxazin-6-yl)-3-chloro-benzothiophene-2-carboxamide Formula: C20H15ClN2O3S MolecularWeight: 398.8627

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=O)COC2=C1C=C(C=C2)NC(=O)C3=C(C4=CC=CC=C4S3)Cl

Isomeric SMILES

C=CCN1C(=O)COC2=C1C=C(C=C2)NC(=O)C3=C(C4=CC=CC=C4S3)Cl

InChI

InChI=1S/C20H15ClN2O3S/c1-2-9-23-14-10-12(7-8-15(14)26-11-17(23)24)22-20(25)19-18(21)13-5-3-4-6-16(13)27-19/h2-8,10H,1,9,11H2,(H,22,25)