3-[[4-[4-(3-acetamidopropyl)phenyl]-1,3-thiazol-2-yl]carbamoyl]pyridin-2-olate

Systemtic Name: 3-[[4-[4-(3-acetamidopropyl)phenyl]-1,3-thiazol-2-yl]carbamoyl]pyridin-2-olate Openeye Name: 3-[[4-[4-(3-acetamidopropyl)phenyl]thiazol-2-yl]carbamoyl]pyridin-2-olate CAS Name: 3-[[[4-[4-(3-acetamidopropyl)phenyl]-2-thiazolyl]amino]-oxomethyl]-2-pyridinolate IUPAC Name: 3-[[4-[4-(3-acetamidopropyl)phenyl]-1,3-thiazol-2-yl]carbamoyl]pyridin-2-olate Traditional Name: 3-[[4-[4-(3-acetamidopropyl)phenyl]thiazol-2-yl]carbamoyl]pyridin-2-olate Formula: C20H19N4O3S- MolecularWeight: 395.45486

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCCCC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C3=C(N=CC=C3)[O-]

Isomeric SMILES

CC(=O)NCCCC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C3=C(N=CC=C3)[O-]

InChI

InChI=1S/C20H20N4O3S/c1-13(25)21-10-2-4-14-6-8-15(9-7-14)17-12-28-20(23-17)24-19(27)16-5-3-11-22-18(16)26/h3,5-9,11-12H,2,4,10H2,1H3,(H,21,25)(H,22,26)(H,23,24,27)/p-1