N-[2-[3-[2-(1,3-benzothiazol-2-ylamino)-2-oxidanylidene-ethyl]sulfanylindol-1-yl]ethyl]-4-ethoxy-benzamide

Systemtic Name: N-[2-[3-[2-(1,3-benzothiazol-2-ylamino)-2-oxidanylidene-ethyl]sulfanylindol-1-yl]ethyl]-4-ethoxy-benzamide Openeye Name: N-[2-[3-[2-(1,3-benzothiazol-2-ylamino)-2-oxo-ethyl]sulfanylindol-1-yl]ethyl]-4-ethoxy-benzamide CAS Name: N-[2-[3-[[2-(1,3-benzothiazol-2-ylamino)-2-oxoethyl]thio]-1-indolyl]ethyl]-4-ethoxybenzamide IUPAC Name: N-[2-[3-[2-(1,3-benzothiazol-2-ylamino)-2-oxoethyl]sulfanylindol-1-yl]ethyl]-4-ethoxybenzamide Traditional Name: N-[2-[3-[[2-(1,3-benzothiazol-2-ylamino)-2-keto-ethyl]thio]indol-1-yl]ethyl]-4-ethoxy-benzamide Formula: C28H26N4O3S2 MolecularWeight: 530.66104

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(=O)NCCN2C=C(C3=CC=CC=C32)SCC(=O)NC4=NC5=CC=CC=C5S4

Isomeric SMILES

CCOC1=CC=C(C=C1)C(=O)NCCN2C=C(C3=CC=CC=C32)SCC(=O)NC4=NC5=CC=CC=C5S4

InChI

InChI=1S/C28H26N4O3S2/c1-2-35-20-13-11-19(12-14-20)27(34)29-15-16-32-17-25(21-7-3-5-9-23(21)32)36-18-26(33)31-28-30-22-8-4-6-10-24(22)37-28/h3-14,17H,2,15-16,18H2,1H3,(H,29,34)(H,30,31,33)