N-[3-(benzo[e][1,3]benzothiazol-2-ylamino)-3-oxidanylidene-propyl]-2-methoxy-benzamide

Systemtic Name: N-[3-(benzo[e][1,3]benzothiazol-2-ylamino)-3-oxidanylidene-propyl]-2-methoxy-benzamide Openeye Name: N-[3-(benzo[e][1,3]benzothiazol-2-ylamino)-3-oxo-propyl]-2-methoxy-benzamide CAS Name: N-[3-(2-benzo[e][1,3]benzothiazolylamino)-3-oxopropyl]-2-methoxybenzamide IUPAC Name: N-[3-(benzo[e][1,3]benzothiazol-2-ylamino)-3-oxopropyl]-2-methoxybenzamide Traditional Name: N-[3-(benzo[e][1,3]benzothiazol-2-ylamino)-3-keto-propyl]-2-methoxy-benzamide Formula: C22H19N3O3S MolecularWeight: 405.46956

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C(=O)NCCC(=O)NC2=NC3=C(S2)C=CC4=CC=CC=C43

Isomeric SMILES

COC1=CC=CC=C1C(=O)NCCC(=O)NC2=NC3=C(S2)C=CC4=CC=CC=C43

InChI

InChI=1S/C22H19N3O3S/c1-28-17-9-5-4-8-16(17)21(27)23-13-12-19(26)24-22-25-20-15-7-3-2-6-14(15)10-11-18(20)29-22/h2-11H,12-13H2,1H3,(H,23,27)(H,24,25,26)