1-propan-2-yl-3-(1-propan-2-ylsulfonylpiperidin-4-yl)-1-(2-sulfanylidene-3H-1,3-benzothiazol-6-yl)urea

Systemtic Name: 1-propan-2-yl-3-(1-propan-2-ylsulfonylpiperidin-4-yl)-1-(2-sulfanylidene-3H-1,3-benzothiazol-6-yl)urea Openeye Name: 1-isopropyl-3-(1-isopropylsulfonyl-4-piperidyl)-1-(2-thioxo-3H-1,3-benzothiazol-6-yl)urea CAS Name: 1-propan-2-yl-3-(1-propan-2-ylsulfonyl-4-piperidinyl)-1-(2-sulfanylidene-3H-1,3-benzothiazol-6-yl)urea IUPAC Name: 1-propan-2-yl-3-(1-propan-2-ylsulfonylpiperidin-4-yl)-1-(2-sulfanylidene-3H-1,3-benzothiazol-6-yl)urea Traditional Name: 1-isopropyl-3-(1-isopropylsulfonyl-4-piperidyl)-1-(2-thioxo-3H-1,3-benzothiazol-6-yl)urea Formula: C19H28N4O3S3 MolecularWeight: 456.64562

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(C1=CC2=C(C=C1)NC(=S)S2)C(=O)NC3CCN(CC3)S(=O)(=O)C(C)C

Isomeric SMILES

CC(C)N(C1=CC2=C(C=C1)NC(=S)S2)C(=O)NC3CCN(CC3)S(=O)(=O)C(C)C

InChI

InChI=1S/C19H28N4O3S3/c1-12(2)23(15-5-6-16-17(11-15)28-19(27)21-16)18(24)20-14-7-9-22(10-8-14)29(25,26)13(3)4/h5-6,11-14H,7-10H2,1-4H3,(H,20,24)(H,21,27)