1-[4-[(4-methylphenyl)methyl]-3-oxidanylidene-1,4-benzothiazin-6-yl]-3-(oxolan-2-ylmethyl)urea

Systemtic Name: 1-[4-[(4-methylphenyl)methyl]-3-oxidanylidene-1,4-benzothiazin-6-yl]-3-(oxolan-2-ylmethyl)urea Openeye Name: 1-[3-oxo-4-(p-tolylmethyl)-1,4-benzothiazin-6-yl]-3-(tetrahydrofuran-2-ylmethyl)urea CAS Name: 1-[4-[(4-methylphenyl)methyl]-3-oxo-1,4-benzothiazin-6-yl]-3-(2-oxolanylmethyl)urea IUPAC Name: 1-[4-[(4-methylphenyl)methyl]-3-oxo-1,4-benzothiazin-6-yl]-3-(oxolan-2-ylmethyl)urea Traditional Name: 1-[3-keto-4-(4-methylbenzyl)-1,4-benzothiazin-6-yl]-3-(tetrahydrofurfuryl)urea Formula: C22H25N3O3S MolecularWeight: 411.5172

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C(=O)CSC3=C2C=C(C=C3)NC(=O)NCC4CCCO4

Isomeric SMILES

CC1=CC=C(C=C1)CN2C(=O)CSC3=C2C=C(C=C3)NC(=O)NCC4CCCO4

InChI

InChI=1S/C22H25N3O3S/c1-15-4-6-16(7-5-15)13-25-19-11-17(8-9-20(19)29-14-21(25)26)24-22(27)23-12-18-3-2-10-28-18/h4-9,11,18H,2-3,10,12-14H2,1H3,(H2,23,24,27)