1-[(E)-[1-(4-methylphenyl)sulfonyl-4,5-dihydro-2H-1-benzazepin-3-ylidene]amino]urea

Systemtic Name: 1-[(E)-[1-(4-methylphenyl)sulfonyl-4,5-dihydro-2H-1-benzazepin-3-ylidene]amino]urea Openeye Name: [(E)-[1-(p-tolylsulfonyl)-4,5-dihydro-2H-1-benzazepin-3-ylidene]amino]urea CAS Name: [(E)-[1-(4-methylphenyl)sulfonyl-4,5-dihydro-2H-1-benzazepin-3-ylidene]amino]urea IUPAC Name: [(E)-[1-(4-methylphenyl)sulfonyl-4,5-dihydro-2H-1-benzazepin-3-ylidene]amino]urea Traditional Name: [(E)-(1-tosyl-4,5-dihydro-2H-1-benzazepin-3-ylidene)amino]urea Formula: C18H20N4O3S MolecularWeight: 372.4414

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CC(=NNC(=O)N)CCC3=CC=CC=C32

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C/C(=N/NC(=O)N)/CCC3=CC=CC=C32

InChI

InChI=1S/C18H20N4O3S/c1-13-6-10-16(11-7-13)26(24,25)22-12-15(20-21-18(19)23)9-8-14-4-2-3-5-17(14)22/h2-7,10-11H,8-9,12H2,1H3,(H3,19,21,23)/b20-15+