N-(6-methoxy-1,3-benzothiazol-2-yl)-5-(pyrrolidin-1-ylmethyl)-1,2-oxazole-3-carboxamide

Systemtic Name: N-(6-methoxy-1,3-benzothiazol-2-yl)-5-(pyrrolidin-1-ylmethyl)-1,2-oxazole-3-carboxamide Openeye Name: N-(6-methoxy-1,3-benzothiazol-2-yl)-5-(pyrrolidin-1-ylmethyl)isoxazole-3-carboxamide CAS Name: N-(6-methoxy-1,3-benzothiazol-2-yl)-5-(1-pyrrolidinylmethyl)-3-isoxazolecarboxamide IUPAC Name: N-(6-methoxy-1,3-benzothiazol-2-yl)-5-(pyrrolidin-1-ylmethyl)-1,2-oxazole-3-carboxamide Traditional Name: N-(6-methoxy-1,3-benzothiazol-2-yl)-5-(pyrrolidinomethyl)isoxazole-3-carboxamide Formula: C17H18N4O3S MolecularWeight: 358.41482

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=NOC(=C3)CN4CCCC4

Isomeric SMILES

COC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=NOC(=C3)CN4CCCC4

InChI

InChI=1S/C17H18N4O3S/c1-23-11-4-5-13-15(9-11)25-17(18-13)19-16(22)14-8-12(24-20-14)10-21-6-2-3-7-21/h4-5,8-9H,2-3,6-7,10H2,1H3,(H,18,19,22)