1-(1-adamantyl)-3-[3-[2-[(3-methoxyphenyl)carbamothioyl]hydrazinyl]-3-oxidanylidene-propyl]urea

Systemtic Name: 1-(1-adamantyl)-3-[3-[2-[(3-methoxyphenyl)carbamothioyl]hydrazinyl]-3-oxidanylidene-propyl]urea Openeye Name: 1-(1-adamantyl)-3-[3-[2-[(3-methoxyphenyl)carbamothioyl]hydrazino]-3-oxo-propyl]urea CAS Name: 1-(1-adamantyl)-3-[3-[[(3-methoxyanilino)-sulfanylidenemethyl]hydrazo]-3-oxopropyl]urea IUPAC Name: 1-(1-adamantyl)-3-[3-[2-[(3-methoxyphenyl)carbamothioyl]hydrazinyl]-3-oxopropyl]urea Traditional Name: 1-(1-adamantyl)-3-[3-keto-3-[N'-[(3-methoxyphenyl)thiocarbamoyl]hydrazino]propyl]urea Formula: C22H31N5O3S MolecularWeight: 445.57824

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC(=S)NNC(=O)CCNC(=O)NC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

COC1=CC=CC(=C1)NC(=S)NNC(=O)CCNC(=O)NC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C22H31N5O3S/c1-30-18-4-2-3-17(10-18)24-21(31)27-26-19(28)5-6-23-20(29)25-22-11-14-7-15(12-22)9-16(8-14)13-22/h2-4,10,14-16H,5-9,11-13H2,1H3,(H,26,28)(H2,23,25,29)(H2,24,27,31)