3-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]-N-[(2R)-4-(furan-2-yl)butan-2-yl]propanamide

Systemtic Name: 3-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]-N-[(2R)-4-(furan-2-yl)butan-2-yl]propanamide Openeye Name: 3-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-N-[(1R)-3-(2-furyl)-1-methyl-propyl]propanamide CAS Name: 3-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-N-[(2R)-4-(2-furanyl)butan-2-yl]propanamide IUPAC Name: 3-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-N-[(2R)-4-(furan-2-yl)butan-2-yl]propanamide Traditional Name: 3-[(1,1-diketo-1,2-benzothiazol-3-yl)amino]-N-[(1R)-3-(2-furyl)-1-methyl-propyl]propionamide Formula: C18H21N3O4S MolecularWeight: 375.44204

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=CO1)NC(=O)CCNC2=NS(=O)(=O)C3=CC=CC=C32

Isomeric SMILES

C[C@H](CCC1=CC=CO1)NC(=O)CCNC2=NS(=O)(=O)C3=CC=CC=C32

InChI

InChI=1S/C18H21N3O4S/c1-13(8-9-14-5-4-12-25-14)20-17(22)10-11-19-18-15-6-2-3-7-16(15)26(23,24)21-18/h2-7,12-13H,8-11H2,1H3,(H,19,21)(H,20,22)/t13-/m1/s1