N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-(3-methoxyphenyl)piperazine-1-carbothioamide

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-(3-methoxyphenyl)piperazine-1-carbothioamide Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-(3-methoxyphenyl)piperazine-1-carbothioamide CAS Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-(3-methoxyphenyl)-1-piperazinecarbothioamide IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-(3-methoxyphenyl)piperazine-1-carbothioamide Traditional Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-(3-methoxyphenyl)piperazine-1-carbothioamide Formula: C20H23N3O3S MolecularWeight: 385.47992

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N2CCN(CC2)C(=S)NC3=CC4=C(C=C3)OCCO4

Isomeric SMILES

COC1=CC=CC(=C1)N2CCN(CC2)C(=S)NC3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C20H23N3O3S/c1-24-17-4-2-3-16(14-17)22-7-9-23(10-8-22)20(27)21-15-5-6-18-19(13-15)26-12-11-25-18/h2-6,13-14H,7-12H2,1H3,(H,21,27)