N-[2-(3-methylthiophen-2-yl)ethyl]-3-[(3-oxidanylidene-4H-1,4-benzothiazin-6-yl)sulfonyl]propanamide

Systemtic Name: N-[2-(3-methylthiophen-2-yl)ethyl]-3-[(3-oxidanylidene-4H-1,4-benzothiazin-6-yl)sulfonyl]propanamide Openeye Name: N-[2-(3-methyl-2-thienyl)ethyl]-3-[(3-oxo-4H-1,4-benzothiazin-6-yl)sulfonyl]propanamide CAS Name: N-[2-(3-methyl-2-thiophenyl)ethyl]-3-[(3-oxo-4H-1,4-benzothiazin-6-yl)sulfonyl]propanamide IUPAC Name: N-[2-(3-methylthiophen-2-yl)ethyl]-3-[(3-oxo-4H-1,4-benzothiazin-6-yl)sulfonyl]propanamide Traditional Name: 3-[(3-keto-4H-1,4-benzothiazin-6-yl)sulfonyl]-N-[2-(3-methyl-2-thienyl)ethyl]propionamide Formula: C18H20N2O4S3 MolecularWeight: 424.5574

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)CCNC(=O)CCS(=O)(=O)C2=CC3=C(C=C2)SCC(=O)N3

Isomeric SMILES

CC1=C(SC=C1)CCNC(=O)CCS(=O)(=O)C2=CC3=C(C=C2)SCC(=O)N3

InChI

InChI=1S/C18H20N2O4S3/c1-12-5-8-25-15(12)4-7-19-17(21)6-9-27(23,24)13-2-3-16-14(10-13)20-18(22)11-26-16/h2-3,5,8,10H,4,6-7,9,11H2,1H3,(H,19,21)(H,20,22)