N-(2-dimethylaminoethyl)-N-(6-ethoxy-1,3-benzothiazol-2-yl)-4-(phenylmethyl)benzamide

Systemtic Name: N-(2-dimethylaminoethyl)-N-(6-ethoxy-1,3-benzothiazol-2-yl)-4-(phenylmethyl)benzamide Openeye Name: 4-benzyl-N-(2-dimethylaminoethyl)-N-(6-ethoxy-1,3-benzothiazol-2-yl)benzamide CAS Name: N-(2-dimethylaminoethyl)-N-(6-ethoxy-1,3-benzothiazol-2-yl)-4-(phenylmethyl)benzamide IUPAC Name: 4-benzyl-N-(2-dimethylaminoethyl)-N-(6-ethoxy-1,3-benzothiazol-2-yl)benzamide Traditional Name: 4-benzyl-N-(2-dimethylaminoethyl)-N-(6-ethoxy-1,3-benzothiazol-2-yl)benzamide Formula: C27H29N3O2S MolecularWeight: 459.60306

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)N(CCN(C)C)C(=O)C3=CC=C(C=C3)CC4=CC=CC=C4

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)N(CCN(C)C)C(=O)C3=CC=C(C=C3)CC4=CC=CC=C4

InChI

InChI=1S/C27H29N3O2S/c1-4-32-23-14-15-24-25(19-23)33-27(28-24)30(17-16-29(2)3)26(31)22-12-10-21(11-13-22)18-20-8-6-5-7-9-20/h5-15,19H,4,16-18H2,1-3H3