1-[(Z)-[5-(1,3-benzothiazol-2-ylsulfanylmethyl)-3-butyl-3-ethanoyl-oxolan-2-ylidene]amino]urea

Systemtic Name: 1-[(Z)-[5-(1,3-benzothiazol-2-ylsulfanylmethyl)-3-butyl-3-ethanoyl-oxolan-2-ylidene]amino]urea Openeye Name: [(Z)-[3-acetyl-5-(1,3-benzothiazol-2-ylsulfanylmethyl)-3-butyl-tetrahydrofuran-2-ylidene]amino]urea CAS Name: [(Z)-[3-acetyl-5-[(1,3-benzothiazol-2-ylthio)methyl]-3-butyl-2-oxolanylidene]amino]urea IUPAC Name: [(Z)-[3-acetyl-5-(1,3-benzothiazol-2-ylsulfanylmethyl)-3-butyloxolan-2-ylidene]amino]urea Traditional Name: [(Z)-[3-acetyl-5-[(1,3-benzothiazol-2-ylthio)methyl]-3-butyl-tetrahydrofuran-2-ylidene]amino]urea Formula: C19H24N4O3S2 MolecularWeight: 420.54886

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1(CC(OC1=NNC(=O)N)CSC2=NC3=CC=CC=C3S2)C(=O)C

Isomeric SMILES

CCCCC\1(CC(O/C1=N\NC(=O)N)CSC2=NC3=CC=CC=C3S2)C(=O)C

InChI

InChI=1S/C19H24N4O3S2/c1-3-4-9-19(12(2)24)10-13(26-16(19)22-23-17(20)25)11-27-18-21-14-7-5-6-8-15(14)28-18/h5-8,13H,3-4,9-11H2,1-2H3,(H3,20,23,25)/b22-16-