N-[2-(5-chloranyl-2,3-dihydro-1,4-benzodioxin-7-yl)ethyl]-3-phenyl-thiophene-2-carboxamide

Systemtic Name: N-[2-(5-chloranyl-2,3-dihydro-1,4-benzodioxin-7-yl)ethyl]-3-phenyl-thiophene-2-carboxamide Openeye Name: N-[2-(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)ethyl]-3-phenyl-thiophene-2-carboxamide CAS Name: N-[2-(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)ethyl]-3-phenyl-2-thiophenecarboxamide IUPAC Name: N-[2-(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)ethyl]-3-phenylthiophene-2-carboxamide Traditional Name: N-[2-(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)ethyl]-3-phenyl-thiophene-2-carboxamide Formula: C21H18ClNO3S MolecularWeight: 399.89052

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=C(C=C2Cl)CCNC(=O)C3=C(C=CS3)C4=CC=CC=C4

Isomeric SMILES

C1COC2=C(O1)C=C(C=C2Cl)CCNC(=O)C3=C(C=CS3)C4=CC=CC=C4

InChI

InChI=1S/C21H18ClNO3S/c22-17-12-14(13-18-19(17)26-10-9-25-18)6-8-23-21(24)20-16(7-11-27-20)15-4-2-1-3-5-15/h1-5,7,11-13H,6,8-10H2,(H,23,24)