N-[3-[1,3-benzothiazol-2-yl(oxolan-2-ylmethyl)amino]-3-oxidanylidene-propyl]thiophene-3-carboxamide

Systemtic Name: N-[3-[1,3-benzothiazol-2-yl(oxolan-2-ylmethyl)amino]-3-oxidanylidene-propyl]thiophene-3-carboxamide Openeye Name: N-[3-[1,3-benzothiazol-2-yl(tetrahydrofuran-2-ylmethyl)amino]-3-oxo-propyl]thiophene-3-carboxamide CAS Name: N-[3-[1,3-benzothiazol-2-yl(2-oxolanylmethyl)amino]-3-oxopropyl]-3-thiophenecarboxamide IUPAC Name: N-[3-[1,3-benzothiazol-2-yl(oxolan-2-ylmethyl)amino]-3-oxopropyl]thiophene-3-carboxamide Traditional Name: N-[3-[1,3-benzothiazol-2-yl(tetrahydrofurfuryl)amino]-3-keto-propyl]thiophene-3-carboxamide Formula: C20H21N3O3S2 MolecularWeight: 415.52904

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CN(C2=NC3=CC=CC=C3S2)C(=O)CCNC(=O)C4=CSC=C4

Isomeric SMILES

C1CC(OC1)CN(C2=NC3=CC=CC=C3S2)C(=O)CCNC(=O)C4=CSC=C4

InChI

InChI=1S/C20H21N3O3S2/c24-18(7-9-21-19(25)14-8-11-27-13-14)23(12-15-4-3-10-26-15)20-22-16-5-1-2-6-17(16)28-20/h1-2,5-6,8,11,13,15H,3-4,7,9-10,12H2,(H,21,25)