1-[(Z)-4-(1,3-benzodioxol-5-yl)butan-2-ylideneamino]-3-cyclohexyl-thiourea

Systemtic Name: 1-[(Z)-4-(1,3-benzodioxol-5-yl)butan-2-ylideneamino]-3-cyclohexyl-thiourea Openeye Name: 1-[(Z)-[3-(1,3-benzodioxol-5-yl)-1-methyl-propylidene]amino]-3-cyclohexyl-thiourea CAS Name: 1-[(Z)-4-(1,3-benzodioxol-5-yl)butan-2-ylideneamino]-3-cyclohexylthiourea IUPAC Name: 1-[(Z)-4-(1,3-benzodioxol-5-yl)butan-2-ylideneamino]-3-cyclohexylthiourea Traditional Name: 1-[(Z)-[3-(1,3-benzodioxol-5-yl)-1-methyl-propylidene]amino]-3-cyclohexyl-thiourea Formula: C18H25N3O2S MolecularWeight: 347.475

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=S)NC1CCCCC1)CCC2=CC3=C(C=C2)OCO3

Isomeric SMILES

C/C(=N/NC(=S)NC1CCCCC1)/CCC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C18H25N3O2S/c1-13(20-21-18(24)19-15-5-3-2-4-6-15)7-8-14-9-10-16-17(11-14)23-12-22-16/h9-11,15H,2-8,12H2,1H3,(H2,19,21,24)/b20-13-