2-(3-methylpentanoylamino)-7-oxidanylidene-N-prop-2-enyl-5,6-dihydro-4H-1,3-benzothiazole-5-carboxamide

Systemtic Name: 2-(3-methylpentanoylamino)-7-oxidanylidene-N-prop-2-enyl-5,6-dihydro-4H-1,3-benzothiazole-5-carboxamide Openeye Name: N-allyl-2-(3-methylpentanoylamino)-7-oxo-5,6-dihydro-4H-1,3-benzothiazole-5-carboxamide CAS Name: 2-[(3-methyl-1-oxopentyl)amino]-7-oxo-N-prop-2-enyl-5,6-dihydro-4H-1,3-benzothiazole-5-carboxamide IUPAC Name: 2-(3-methylpentanoylamino)-7-oxo-N-prop-2-enyl-5,6-dihydro-4H-1,3-benzothiazole-5-carboxamide Traditional Name: N-allyl-7-keto-2-(3-methylpentanoylamino)-5,6-dihydro-4H-1,3-benzothiazole-5-carboxamide Formula: C17H23N3O3S MolecularWeight: 349.44782

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)CC(=O)NC1=NC2=C(S1)C(=O)CC(C2)C(=O)NCC=C

Isomeric SMILES

CCC(C)CC(=O)NC1=NC2=C(S1)C(=O)CC(C2)C(=O)NCC=C

InChI

InChI=1S/C17H23N3O3S/c1-4-6-18-16(23)11-8-12-15(13(21)9-11)24-17(19-12)20-14(22)7-10(3)5-2/h4,10-11H,1,5-9H2,2-3H3,(H,18,23)(H,19,20,22)