5-tert-butyl-N-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide

Systemtic Name: 5-tert-butyl-N-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide Openeye Name: 5-tert-butyl-N-[4-(morpholinomethyl)thiazol-2-yl]-4,5,6,7-tetrahydrobenzothiophene-2-carboxamide CAS Name: 5-tert-butyl-N-[4-(4-morpholinylmethyl)-2-thiazolyl]-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide IUPAC Name: 5-tert-butyl-N-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide Traditional Name: 5-tert-butyl-N-[4-(morpholinomethyl)thiazol-2-yl]-4,5,6,7-tetrahydrobenzothiophene-2-carboxamide Formula: C21H29N3O2S2 MolecularWeight: 419.60386

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CCC2=C(C1)C=C(S2)C(=O)NC3=NC(=CS3)CN4CCOCC4

Isomeric SMILES

CC(C)(C)C1CCC2=C(C1)C=C(S2)C(=O)NC3=NC(=CS3)CN4CCOCC4

InChI

InChI=1S/C21H29N3O2S2/c1-21(2,3)15-4-5-17-14(10-15)11-18(28-17)19(25)23-20-22-16(13-27-20)12-24-6-8-26-9-7-24/h11,13,15H,4-10,12H2,1-3H3,(H,22,23,25)