1-(1,3-benzodioxol-5-yl)-3-[(4-cyclopentyloxyphenyl)carbonylamino]thiourea

Systemtic Name: 1-(1,3-benzodioxol-5-yl)-3-[(4-cyclopentyloxyphenyl)carbonylamino]thiourea Openeye Name: 1-(1,3-benzodioxol-5-yl)-3-[[4-(cyclopentoxy)benzoyl]amino]thiourea CAS Name: 1-(1,3-benzodioxol-5-yl)-3-[[(4-cyclopentyloxyphenyl)-oxomethyl]amino]thiourea IUPAC Name: 1-(1,3-benzodioxol-5-yl)-3-[(4-cyclopentyloxybenzoyl)amino]thiourea Traditional Name: 1-(1,3-benzodioxol-5-yl)-3-[[4-(cyclopentoxy)benzoyl]amino]thiourea Formula: C20H21N3O4S MolecularWeight: 399.46344

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)OC2=CC=C(C=C2)C(=O)NNC(=S)NC3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1CCC(C1)OC2=CC=C(C=C2)C(=O)NNC(=S)NC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C20H21N3O4S/c24-19(13-5-8-16(9-6-13)27-15-3-1-2-4-15)22-23-20(28)21-14-7-10-17-18(11-14)26-12-25-17/h5-11,15H,1-4,12H2,(H,22,24)(H2,21,23,28)