N2-[[2-(aminocarbonylamino)-1,3-benzothiazol-5-yl]methyl]-N6-propan-2-yl-pyridine-2,6-dicarboxamide

Systemtic Name: N2-[[2-(aminocarbonylamino)-1,3-benzothiazol-5-yl]methyl]-N6-propan-2-yl-pyridine-2,6-dicarboxamide Openeye Name: N6-isopropyl-N2-[(2-ureido-1,3-benzothiazol-5-yl)methyl]pyridine-2,6-dicarboxamide CAS Name: N2-[[2-(carbamoylamino)-1,3-benzothiazol-5-yl]methyl]-N6-propan-2-ylpyridine-2,6-dicarboxamide IUPAC Name: 2-N-[[2-(carbamoylamino)-1,3-benzothiazol-5-yl]methyl]-6-N-propan-2-ylpyridine-2,6-dicarboxamide Traditional Name: N'-isopropyl-N-[(2-ureido-1,3-benzothiazol-5-yl)methyl]dipicolinamide Formula: C19H20N6O3S MolecularWeight: 412.4655

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C1=CC=CC(=N1)C(=O)NCC2=CC3=C(C=C2)SC(=N3)NC(=O)N

Isomeric SMILES

CC(C)NC(=O)C1=CC=CC(=N1)C(=O)NCC2=CC3=C(C=C2)SC(=N3)NC(=O)N

InChI

InChI=1S/C19H20N6O3S/c1-10(2)22-17(27)13-5-3-4-12(23-13)16(26)21-9-11-6-7-15-14(8-11)24-19(29-15)25-18(20)28/h3-8,10H,9H2,1-2H3,(H,21,26)(H,22,27)(H3,20,24,25,28)