1-(4-butylphenyl)-3-[4-(4-chlorophenyl)sulfonyl-1,4-thiazinan-1-ylidene]urea

Systemtic Name: 1-(4-butylphenyl)-3-[4-(4-chlorophenyl)sulfonyl-1,4-thiazinan-1-ylidene]urea Openeye Name: 1-(4-butylphenyl)-3-[4-(4-chlorophenyl)sulfonyl-1,4-thiazinan-1-ylidene]urea CAS Name: 1-(4-butylphenyl)-3-[4-(4-chlorophenyl)sulfonyl-1,4-thiazinan-1-ylidene]urea IUPAC Name: 1-(4-butylphenyl)-3-[4-(4-chlorophenyl)sulfonyl-1,4-thiazinan-1-ylidene]urea Traditional Name: 1-(4-butylphenyl)-3-[4-(4-chlorophenyl)sulfonyl-1,4-thiazinan-1-ylidene]urea Formula: C21H26ClN3O3S2 MolecularWeight: 468.03244

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=O)N=S2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=O)N=S2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H26ClN3O3S2/c1-2-3-4-17-5-9-19(10-6-17)23-21(26)24-29-15-13-25(14-16-29)30(27,28)20-11-7-18(22)8-12-20/h5-12H,2-4,13-16H2,1H3,(H,23,26)