N-(2-diethylaminoethyl)-N-(6-methylsulfanyl-1,3-benzothiazol-2-yl)-4-phenyl-benzamide

Systemtic Name: N-(2-diethylaminoethyl)-N-(6-methylsulfanyl-1,3-benzothiazol-2-yl)-4-phenyl-benzamide Openeye Name: N-(2-diethylaminoethyl)-N-(6-methylsulfanyl-1,3-benzothiazol-2-yl)-4-phenyl-benzamide CAS Name: N-(2-diethylaminoethyl)-N-[6-(methylthio)-1,3-benzothiazol-2-yl]-4-phenylbenzamide IUPAC Name: N-(2-diethylaminoethyl)-N-(6-methylsulfanyl-1,3-benzothiazol-2-yl)-4-phenylbenzamide Traditional Name: N-(2-diethylaminoethyl)-N-[6-(methylthio)-1,3-benzothiazol-2-yl]-4-phenyl-benzamide Formula: C27H29N3OS2 MolecularWeight: 475.66866

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCN(C1=NC2=C(S1)C=C(C=C2)SC)C(=O)C3=CC=C(C=C3)C4=CC=CC=C4

Isomeric SMILES

CCN(CC)CCN(C1=NC2=C(S1)C=C(C=C2)SC)C(=O)C3=CC=C(C=C3)C4=CC=CC=C4

InChI

InChI=1S/C27H29N3OS2/c1-4-29(5-2)17-18-30(27-28-24-16-15-23(32-3)19-25(24)33-27)26(31)22-13-11-21(12-14-22)20-9-7-6-8-10-20/h6-16,19H,4-5,17-18H2,1-3H3