N-[2-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-1,3-benzothiazol-6-yl]-4-methoxy-benzamide

Systemtic Name: N-[2-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-1,3-benzothiazol-6-yl]-4-methoxy-benzamide Openeye Name: N-[2-(2-amino-2-oxo-ethyl)sulfanyl-1,3-benzothiazol-6-yl]-4-methoxy-benzamide CAS Name: N-[2-[(2-amino-2-oxoethyl)thio]-1,3-benzothiazol-6-yl]-4-methoxybenzamide IUPAC Name: N-[2-(2-amino-2-oxoethyl)sulfanyl-1,3-benzothiazol-6-yl]-4-methoxybenzamide Traditional Name: N-[2-[(2-amino-2-keto-ethyl)thio]-1,3-benzothiazol-6-yl]-4-methoxy-benzamide Formula: C17H15N3O3S2 MolecularWeight: 373.4493

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)NC2=CC3=C(C=C2)N=C(S3)SCC(=O)N

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)NC2=CC3=C(C=C2)N=C(S3)SCC(=O)N

InChI

InChI=1S/C17H15N3O3S2/c1-23-12-5-2-10(3-6-12)16(22)19-11-4-7-13-14(8-11)25-17(20-13)24-9-15(18)21/h2-8H,9H2,1H3,(H2,18,21)(H,19,22)