N-(2-dimethylaminoethyl)-3-[(4-methyl-1,3-benzoxazol-2-yl)sulfanylmethyl]-N-(phenylmethyl)benzamide

Systemtic Name: N-(2-dimethylaminoethyl)-3-[(4-methyl-1,3-benzoxazol-2-yl)sulfanylmethyl]-N-(phenylmethyl)benzamide Openeye Name: N-benzyl-N-(2-dimethylaminoethyl)-3-[(4-methyl-1,3-benzoxazol-2-yl)sulfanylmethyl]benzamide CAS Name: N-(2-dimethylaminoethyl)-3-[[(4-methyl-1,3-benzoxazol-2-yl)thio]methyl]-N-(phenylmethyl)benzamide IUPAC Name: N-benzyl-N-(2-dimethylaminoethyl)-3-[(4-methyl-1,3-benzoxazol-2-yl)sulfanylmethyl]benzamide Traditional Name: N-benzyl-N-(2-dimethylaminoethyl)-3-[[(4-methyl-1,3-benzoxazol-2-yl)thio]methyl]benzamide Formula: C27H29N3O2S MolecularWeight: 459.60306

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)OC(=N2)SCC3=CC=CC(=C3)C(=O)N(CCN(C)C)CC4=CC=CC=C4

Isomeric SMILES

CC1=C2C(=CC=C1)OC(=N2)SCC3=CC=CC(=C3)C(=O)N(CCN(C)C)CC4=CC=CC=C4

InChI

InChI=1S/C27H29N3O2S/c1-20-9-7-14-24-25(20)28-27(32-24)33-19-22-12-8-13-23(17-22)26(31)30(16-15-29(2)3)18-21-10-5-4-6-11-21/h4-14,17H,15-16,18-19H2,1-3H3