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2-[5-(4-aminophenyl)sulfonyl-2H-1,5-benzothiazepin-2-yl]ethanol

2-[5-(4-aminophenyl)sulfonyl-2H-1,5-benzothiazepin-2-yl]ethanol

Systemtic Name:2-[5-(4-aminophenyl)sulfonyl-2H-1,5-benzothiazepin-2-yl]ethanol
Openeye Name:2-[5-(4-aminophenyl)sulfonyl-2H-1,5-benzothiazepin-2-yl]ethanol
CAS Name:2-[5-(4-aminophenyl)sulfonyl-2H-1,5-benzothiazepin-2-yl]ethanol
IUPAC Name:2-[5-(4-aminophenyl)sulfonyl-2H-1,5-benzothiazepin-2-yl]ethanol
Traditional Name:2-(5-sulfanilyl-2H-1,5-benzothiazepin-2-yl)ethanol
Formula: C17H18N2O3S2
MolecularWeight: 362.46642
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N(C=CC(S2)CCO)S(=O)(=O)C3=CC=C(C=C3)N


Isomeric SMILES

C1=CC=C2C(=C1)N(C=CC(S2)CCO)S(=O)(=O)C3=CC=C(C=C3)N


InChI

InChI=1S/C17H18N2O3S2/c18-13-5-7-15(8-6-13)24(21,22)19-11-9-14(10-12-20)23-17-4-2-1-3-16(17)19/h1-9,11,14,20H,10,12,18H2


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