2-(1,3-benzodioxol-5-yl)-4-(furan-2-yl)-2,3-dihydro-1,5-benzothiazepine

Systemtic Name: 2-(1,3-benzodioxol-5-yl)-4-(furan-2-yl)-2,3-dihydro-1,5-benzothiazepine Openeye Name: 2-(1,3-benzodioxol-5-yl)-4-(2-furyl)-2,3-dihydro-1,5-benzothiazepine CAS Name: 2-(1,3-benzodioxol-5-yl)-4-(2-furanyl)-2,3-dihydro-1,5-benzothiazepine IUPAC Name: 2-(1,3-benzodioxol-5-yl)-4-(furan-2-yl)-2,3-dihydro-1,5-benzothiazepine Traditional Name: 2-(1,3-benzodioxol-5-yl)-4-(2-furyl)-2,3-dihydro-1,5-benzothiazepine Formula: C20H15NO3S MolecularWeight: 349.403

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Descriptors Computed from Structure

Canonical SMILES:

C1C(SC2=CC=CC=C2N=C1C3=CC=CO3)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

C1C(SC2=CC=CC=C2N=C1C3=CC=CO3)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C20H15NO3S/c1-2-6-19-14(4-1)21-15(16-5-3-9-22-16)11-20(25-19)13-7-8-17-18(10-13)24-12-23-17/h1-10,20H,11-12H2