1-(2-azanylethyl)-3-(4,7-dimethyl-1,3-benzodioxol-5-yl)thiourea

Systemtic Name: 1-(2-azanylethyl)-3-(4,7-dimethyl-1,3-benzodioxol-5-yl)thiourea Openeye Name: 1-(2-aminoethyl)-3-(4,7-dimethyl-1,3-benzodioxol-5-yl)thiourea CAS Name: 1-(2-aminoethyl)-3-(4,7-dimethyl-1,3-benzodioxol-5-yl)thiourea IUPAC Name: 1-(2-aminoethyl)-3-(4,7-dimethyl-1,3-benzodioxol-5-yl)thiourea Traditional Name: 1-(2-aminoethyl)-3-(4,7-dimethyl-1,3-benzodioxol-5-yl)thiourea Formula: C12H17N3O2S MolecularWeight: 267.34728

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C2=C1OCO2)C)NC(=S)NCCN

Isomeric SMILES

CC1=CC(=C(C2=C1OCO2)C)NC(=S)NCCN

InChI

InChI=1S/C12H17N3O2S/c1-7-5-9(15-12(18)14-4-3-13)8(2)11-10(7)16-6-17-11/h5H,3-4,6,13H2,1-2H3,(H2,14,15,18)