N-(3-chloranyl-4-methoxy-phenyl)-3-[(2-oxidanylidene-1,3,4,5-tetrahydro-1-benzazepin-7-yl)sulfonylamino]propanamide

Systemtic Name: N-(3-chloranyl-4-methoxy-phenyl)-3-[(2-oxidanylidene-1,3,4,5-tetrahydro-1-benzazepin-7-yl)sulfonylamino]propanamide Openeye Name: N-(3-chloro-4-methoxy-phenyl)-3-[(2-oxo-1,3,4,5-tetrahydro-1-benzazepin-7-yl)sulfonylamino]propanamide CAS Name: N-(3-chloro-4-methoxyphenyl)-3-[(2-oxo-1,3,4,5-tetrahydro-1-benzazepin-7-yl)sulfonylamino]propanamide IUPAC Name: N-(3-chloro-4-methoxyphenyl)-3-[(2-oxo-1,3,4,5-tetrahydro-1-benzazepin-7-yl)sulfonylamino]propanamide Traditional Name: N-(3-chloro-4-methoxy-phenyl)-3-[(2-keto-1,3,4,5-tetrahydro-1-benzazepin-7-yl)sulfonylamino]propionamide Formula: C20H22ClN3O5S MolecularWeight: 451.92378

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)CCNS(=O)(=O)C2=CC3=C(C=C2)NC(=O)CCC3)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)CCNS(=O)(=O)C2=CC3=C(C=C2)NC(=O)CCC3)Cl

InChI

InChI=1S/C20H22ClN3O5S/c1-29-18-8-5-14(12-16(18)21)23-20(26)9-10-22-30(27,28)15-6-7-17-13(11-15)3-2-4-19(25)24-17/h5-8,11-12,22H,2-4,9-10H2,1H3,(H,23,26)(H,24,25)