3-[bromanyl-(4-methanoylnaphthalen-2-yl)sulfonyl-amino]-N-(1-pyridin-4-ylpiperidin-4-yl)-2-thiomorpholin-4-yl-propanamide

Systemtic Name: 3-[bromanyl-(4-methanoylnaphthalen-2-yl)sulfonyl-amino]-N-(1-pyridin-4-ylpiperidin-4-yl)-2-thiomorpholin-4-yl-propanamide Openeye Name: 3-[bromo-[(4-formyl-2-naphthyl)sulfonyl]amino]-N-[1-(4-pyridyl)-4-piperidyl]-2-thiomorpholino-propanamide CAS Name: 3-[bromo-[(4-formyl-2-naphthalenyl)sulfonyl]amino]-N-(1-pyridin-4-yl-4-piperidinyl)-2-thiomorpholin-4-ylpropanamide IUPAC Name: 3-[bromo-(4-formylnaphthalen-2-yl)sulfonylamino]-N-(1-pyridin-4-ylpiperidin-4-yl)-2-thiomorpholin-4-ylpropanamide Traditional Name: 3-[bromo-[(4-formyl-2-naphthyl)sulfonyl]amino]-N-[1-(4-pyridyl)-4-piperidyl]-2-thiomorpholino-propionamide Formula: C28H32BrN5O4S2 MolecularWeight: 646.61878

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NC(=O)C(CN(S(=O)(=O)C2=CC3=CC=CC=C3C(=C2)C=O)Br)N4CCSCC4)C5=CC=NC=C5

Isomeric SMILES

C1CN(CCC1NC(=O)C(CN(S(=O)(=O)C2=CC3=CC=CC=C3C(=C2)C=O)Br)N4CCSCC4)C5=CC=NC=C5

InChI

InChI=1S/C28H32BrN5O4S2/c29-34(40(37,38)25-17-21-3-1-2-4-26(21)22(18-25)20-35)19-27(33-13-15-39-16-14-33)28(36)31-23-7-11-32(12-8-23)24-5-9-30-10-6-24/h1-6,9-10,17-18,20,23,27H,7-8,11-16,19H2,(H,31,36)