1-[4-(1-adamantyl)phenyl]-3-(2-dimethylaminoethyl)thiourea

Systemtic Name: 1-[4-(1-adamantyl)phenyl]-3-(2-dimethylaminoethyl)thiourea Openeye Name: 1-[4-(1-adamantyl)phenyl]-3-(2-dimethylaminoethyl)thiourea CAS Name: 1-[4-(1-adamantyl)phenyl]-3-(2-dimethylaminoethyl)thiourea IUPAC Name: 1-[4-(1-adamantyl)phenyl]-3-(2-dimethylaminoethyl)thiourea Traditional Name: 1-[4-(1-adamantyl)phenyl]-3-(2-dimethylaminoethyl)thiourea Formula: C21H31N3S MolecularWeight: 357.55594

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCNC(=S)NC1=CC=C(C=C1)C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CN(C)CCNC(=S)NC1=CC=C(C=C1)C23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C21H31N3S/c1-24(2)8-7-22-20(25)23-19-5-3-18(4-6-19)21-12-15-9-16(13-21)11-17(10-15)14-21/h3-6,15-17H,7-14H2,1-2H3,(H2,22,23,25)