4-(3-methylbutyl)-6-[(E)-(4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-1,4-benzoxazin-3-one

Systemtic Name: 4-(3-methylbutyl)-6-[(E)-(4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-1,4-benzoxazin-3-one Openeye Name: 4-isopentyl-6-[(E)-(4-oxo-2-thioxo-thiazolidin-5-ylidene)methyl]-1,4-benzoxazin-3-one CAS Name: 4-(3-methylbutyl)-6-[(E)-(4-oxo-2-sulfanylidene-5-thiazolidinylidene)methyl]-1,4-benzoxazin-3-one IUPAC Name: 4-(3-methylbutyl)-6-[(E)-(4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-1,4-benzoxazin-3-one Traditional Name: 4-isoamyl-6-[(E)-(4-keto-2-thioxo-thiazolidin-5-ylidene)methyl]-1,4-benzoxazin-3-one Formula: C17H18N2O3S2 MolecularWeight: 362.46642

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1C(=O)COC2=C1C=C(C=C2)C=C3C(=O)NC(=S)S3

Isomeric SMILES

CC(C)CCN1C(=O)COC2=C1C=C(C=C2)/C=C/3\C(=O)NC(=S)S3

InChI

InChI=1S/C17H18N2O3S2/c1-10(2)5-6-19-12-7-11(3-4-13(12)22-9-15(19)20)8-14-16(21)18-17(23)24-14/h3-4,7-8,10H,5-6,9H2,1-2H3,(H,18,21,23)/b14-8+