1-(1-adamantyl)-3-[(E)-[4-(diethylamino)phenyl]methylideneamino]thiourea

Systemtic Name: 1-(1-adamantyl)-3-[(E)-[4-(diethylamino)phenyl]methylideneamino]thiourea Openeye Name: 1-(1-adamantyl)-3-[(E)-[4-(diethylamino)phenyl]methyleneamino]thiourea CAS Name: 1-(1-adamantyl)-3-[(E)-[4-(diethylamino)phenyl]methylideneamino]thiourea IUPAC Name: 1-(1-adamantyl)-3-[(E)-[4-(diethylamino)phenyl]methylideneamino]thiourea Traditional Name: 1-(1-adamantyl)-3-[(E)-[4-(diethylamino)benzylidene]amino]thiourea Formula: C22H32N4S MolecularWeight: 384.58128

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC=C(C=C1)C=NNC(=S)NC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CCN(CC)C1=CC=C(C=C1)/C=N/NC(=S)NC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C22H32N4S/c1-3-26(4-2)20-7-5-16(6-8-20)15-23-25-21(27)24-22-12-17-9-18(13-22)11-19(10-17)14-22/h5-8,15,17-19H,3-4,9-14H2,1-2H3,(H2,24,25,27)/b23-15+