3-(3-oxidanylidene-1,2-benzothiazol-2-yl)-N-(pyridin-4-ylmethyl)propanamide

Systemtic Name: 3-(3-oxidanylidene-1,2-benzothiazol-2-yl)-N-(pyridin-4-ylmethyl)propanamide Openeye Name: 3-(3-oxo-1,2-benzothiazol-2-yl)-N-(4-pyridylmethyl)propanamide CAS Name: 3-(3-oxo-1,2-benzothiazol-2-yl)-N-(pyridin-4-ylmethyl)propanamide IUPAC Name: 3-(3-oxo-1,2-benzothiazol-2-yl)-N-(pyridin-4-ylmethyl)propanamide Traditional Name: 3-(3-keto-1,2-benzothiazol-2-yl)-N-(4-pyridylmethyl)propionamide Formula: C16H15N3O2S MolecularWeight: 313.3742

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(S2)CCC(=O)NCC3=CC=NC=C3

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(S2)CCC(=O)NCC3=CC=NC=C3

InChI

InChI=1S/C16H15N3O2S/c20-15(18-11-12-5-8-17-9-6-12)7-10-19-16(21)13-3-1-2-4-14(13)22-19/h1-6,8-9H,7,10-11H2,(H,18,20)