N-(2-aminophenyl)-4-[[6-(2-morpholin-4-ylethylamino)-1,3-benzothiazol-2-yl]sulfanylmethyl]benzamide

Systemtic Name: N-(2-aminophenyl)-4-[[6-(2-morpholin-4-ylethylamino)-1,3-benzothiazol-2-yl]sulfanylmethyl]benzamide Openeye Name: N-(2-aminophenyl)-4-[[6-(2-morpholinoethylamino)-1,3-benzothiazol-2-yl]sulfanylmethyl]benzamide CAS Name: N-(2-aminophenyl)-4-[[[6-[2-(4-morpholinyl)ethylamino]-1,3-benzothiazol-2-yl]thio]methyl]benzamide IUPAC Name: N-(2-aminophenyl)-4-[[6-(2-morpholin-4-ylethylamino)-1,3-benzothiazol-2-yl]sulfanylmethyl]benzamide Traditional Name: N-(2-aminophenyl)-4-[[[6-(2-morpholinoethylamino)-1,3-benzothiazol-2-yl]thio]methyl]benzamide Formula: C27H29N5O2S2 MolecularWeight: 519.68146

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCNC2=CC3=C(C=C2)N=C(S3)SCC4=CC=C(C=C4)C(=O)NC5=CC=CC=C5N

Isomeric SMILES

C1COCCN1CCNC2=CC3=C(C=C2)N=C(S3)SCC4=CC=C(C=C4)C(=O)NC5=CC=CC=C5N

InChI

InChI=1S/C27H29N5O2S2/c28-22-3-1-2-4-23(22)30-26(33)20-7-5-19(6-8-20)18-35-27-31-24-10-9-21(17-25(24)36-27)29-11-12-32-13-15-34-16-14-32/h1-10,17,29H,11-16,18,28H2,(H,30,33)